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Morpholine, 4-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-

HCID 891289
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Basic information

CAS
57037-01-1
Standard SMILES
Cc1ccc(-n2c(N)c(C(=O)N3CCOCC3)sc2=S)cc1
InChIKey
DYGKDHWVWSAGOQ-UHFFFAOYSA-N
Molecular formula
C15H17N3O2S2
Average molar mass
335.4 g/mol
Monoisotopic mass
335.07621914

Overview

[4-amino-3-(4-methylphenyl)-2-sulfanylidene-5-thiazolyl]-(4-morpholinyl)methanone is a member of morpholines.

Names & identifiers

Preferred name
Morpholine, 4-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-
IUPAC
[4-amino-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-5-yl]-morpholin-4-ylmethanone

Names & synonyms

57037-01-1BRN 12236454-((4-Amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)morpholineMorpholine, 4-((4-amino-2,3-dihydro-3-(4-methylphenyl)-2-thioxo-5-thiazolyl)carbonyl)-RefChem:357581[4-amino-3-(4-methylphenyl)-2-sulfanylidene-5-thiazolyl]-(4-morpholinyl)methanone[4-amino-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-5-yl]-morpholin-4-ylmethanoneMLS000089115SMR0000727984-amino-3-(4-methylphenyl)-5-(4-morpholinylcarbonyl)-1,3-thiazole-2(3H)-thione[4-Amino-3-(4-methylphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl](morpholin-4-yl)methanoneOprea1_267128
Show more names
cid_891289CHEMBL1391676BDBM34472DTXSID20972518CHEBI:117165HMS2461K16STK877254AKOS000348763

Database identifiers

CAS
57037-01-1

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
116 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
495

Related reactions

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Compound notes

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PubChem CID
891289
DTXSID
DTXSID20972518
ChEMBL
CHEMBL1391676
ChEBI
CHEBI:117165