N-[(S)-(4-methylphenyl)-phenyl-methyl]-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(S)-(4-methylphenyl)-phenyl-methyl]-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[(S)-phenyl(p-tolyl)methyl]-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[(S)-(4-methylphenyl)-phenylmethyl]-2-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[(S)-(4-methylphenyl)-phenylmethyl]-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[(S)-phenyl(p-tolyl)methyl]-2-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C24H22N4OS MolecularWeight: 414.52268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3CSC4=NC=NN4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=C3CSC4=NC=NN4

InChI

InChI=1S/C24H22N4OS/c1-17-11-13-19(14-12-17)22(18-7-3-2-4-8-18)27-23(29)21-10-6-5-9-20(21)15-30-24-25-16-26-28-24/h2-14,16,22H,15H2,1H3,(H,27,29)(H,25,26,28)/t22-/m0/s1