N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)triazole-4-carboxamide CAS Name: N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-[(methylthio)methyl]-4-triazolecarboxamide IUPAC Name: N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)triazole-4-carboxamide Traditional Name: N-(2-chlorophenyl)-5-(4-methoxyphenyl)-3-[(methylthio)methyl]triazole-4-carboxamide Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(N=N2)CSC)C(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(N=N2)CSC)C(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C18H17ClN4O2S/c1-25-13-9-7-12(8-10-13)16-17(23(11-26-2)22-21-16)18(24)20-15-6-4-3-5-14(15)19/h3-10H,11H2,1-2H3,(H,20,24)