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

Systemtic Name: 5-azanyl-1-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)triazole-4-carboxamide CAS Name: 5-amino-1-(4-methoxyphenyl)-N-[3-(methylthio)phenyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-(4-methoxyphenyl)-N-(3-methylsulfanylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(4-methoxyphenyl)-N-[3-(methylthio)phenyl]triazole-4-carboxamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC(=CC=C3)SC)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC(=CC=C3)SC)N

InChI

InChI=1S/C17H17N5O2S/c1-24-13-8-6-12(7-9-13)22-16(18)15(20-21-22)17(23)19-11-4-3-5-14(10-11)25-2/h3-10H,18H2,1-2H3,(H,19,23)