N-(4-methylphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(4-methylphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: 3-(methylsulfanylmethyl)-N-(p-tolyl)-5-(2-thienyl)triazole-4-carboxamide CAS Name: N-(4-methylphenyl)-3-[(methylthio)methyl]-5-thiophen-2-yl-4-triazolecarboxamide IUPAC Name: N-(4-methylphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yltriazole-4-carboxamide Traditional Name: 3-[(methylthio)methyl]-N-(p-tolyl)-5-(2-thienyl)triazole-4-carboxamide Formula: C16H16N4OS2 MolecularWeight: 344.45444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC=CS3

InChI

InChI=1S/C16H16N4OS2/c1-11-5-7-12(8-6-11)17-16(21)15-14(13-4-3-9-23-13)18-19-20(15)10-22-2/h3-9H,10H2,1-2H3,(H,17,21)