N-({2-[3-(benzyloxy)prop-1-yn-1-yl]-1,3-thiazol-4-yl}methoxy)-1-(1-methyl-1H-tetrazol-5-yl)-1-phenylmethanimine

HCID 86653114
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Basic information

Standard SMILES
Cn1nnnc1C(=NOCc1csc(C#CCOCc2ccccc2)n1)c1ccccc1
InChIKey
FKXLYDPYJPJJIH-UHFFFAOYSA-N
Molecular formula
C23H20N6O2S
Average molar mass
444.5 g/mol

Names & identifiers

Preferred name
N-({2-[3-(benzyloxy)prop-1-yn-1-yl]-1,3-thiazol-4-yl}methoxy)-1-(1-methyl-1H-tetrazol-5-yl)-1-phenylmethanimine
IUPAC
1-(1-methyltetrazol-5-yl)-1-phenyl-N-[[2-(3-phenylmethoxyprop-1-ynyl)-1,3-thiazol-4-yl]methoxy]methanimine

Names & synonyms

SCHEMBL1862224FKXLYDPYJPJJIH-UHFFFAOYSA-NN-({2-[3-(benzyloxy)prop-1-yn-1-yl]-1,3-thiazol-4-yl}methoxy)-1-(1-methyl-1H-tetrazol-5-yl)-1-phenylmethanimine

Database identifiers

PubChem CID
86653114

Properties

Computed structural properties

XLogP
4
Topological polar surface area
116 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
32

Related reactions

2 records
New reaction record

Linked notes

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