N-[2-(4-methylphenyl)sulfanylethyl]-1-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 1-phenyl-N-[2-(p-tolylsulfanyl)ethyl]triazole-4-carboxamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-1-phenyl-4-triazolecarboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-1-phenyltriazole-4-carboxamide Traditional Name: 1-phenyl-N-[2-(p-tolylthio)ethyl]triazole-4-carboxamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CN(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CN(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4OS/c1-14-7-9-16(10-8-14)24-12-11-19-18(23)17-13-22(21-20-17)15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,19,23)