(4S)-2-(2-methyl-4-nitrophenylimino)-4-isobutyl-3-(cyclopropylmethyl)-1,3-thiazolidine

HCID 57015057
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Basic information

Standard SMILES
Cc1cc([N+](=O)[O-])ccc1N=C1SC[C@H](CC(C)C)N1CC1CC1
InChIKey
QMMCIORFWDOJDL-INIZCTEOSA-N
Molecular formula
C18H25N3O2S
Average molar mass
347.5 g/mol

Names & identifiers

Preferred name
(4S)-2-(2-methyl-4-nitrophenylimino)-4-isobutyl-3-(cyclopropylmethyl)-1,3-thiazolidine
IUPAC
(4S)-3-(cyclopropylmethyl)-N-(2-methyl-4-nitrophenyl)-4-(2-methylpropyl)-1,3-thiazolidin-2-imine

Names & synonyms

SCHEMBL7118096SCHEMBL7118098QMMCIORFWDOJDL-INIZCTEOSA-N(4S)-2-(2-methyl-4-nitrophenylimino)-4-isobutyl-3-(cyclopropylmethyl)-1,3-thiazolidine

Database identifiers

PubChem CID
57015057

Properties

Computed structural properties

XLogP
5
Topological polar surface area
86.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
24

Related reactions

1 records
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Linked notes

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