5-azanyl-N-(3-methoxyphenyl)-1-[(4-methylsulfanylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-N-(3-methoxyphenyl)-1-[(4-methylsulfanylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(3-methoxyphenyl)-1-[(4-methylsulfanylphenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-N-(3-methoxyphenyl)-1-[[4-(methylthio)phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(3-methoxyphenyl)-1-[(4-methylsulfanylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(3-methoxyphenyl)-1-[4-(methylthio)benzyl]triazole-4-carboxamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=C(N(N=N2)CC3=CC=C(C=C3)SC)N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=C(N(N=N2)CC3=CC=C(C=C3)SC)N

InChI

InChI=1S/C18H19N5O2S/c1-25-14-5-3-4-13(10-14)20-18(24)16-17(19)23(22-21-16)11-12-6-8-15(26-2)9-7-12/h3-10H,11,19H2,1-2H3,(H,20,24)