2-(3-chlorophenyl)-5-methyl-N-[2-(phenylmethylsulfanyl)ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)-5-methyl-N-[2-(phenylmethylsulfanyl)ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(3-chlorophenyl)-5-methyl-triazole-4-carboxamide CAS Name: 2-(3-chlorophenyl)-5-methyl-N-[2-(phenylmethylthio)ethyl]-4-triazolecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(3-chlorophenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(3-chlorophenyl)-5-methyl-triazole-4-carboxamide Formula: C19H19ClN4OS MolecularWeight: 386.89836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NCCSCC2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(N=C1C(=O)NCCSCC2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H19ClN4OS/c1-14-18(23-24(22-14)17-9-5-8-16(20)12-17)19(25)21-10-11-26-13-15-6-3-2-4-7-15/h2-9,12H,10-11,13H2,1H3,(H,21,25)