N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[4-(p-tolyl)thiazol-2-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[4-(p-tolyl)thiazol-2-yl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H17N5OS2 MolecularWeight: 407.51188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C20H17N5OS2/c1-13-2-6-15(7-3-13)17-11-28-20(23-17)24-18(26)16-8-4-14(5-9-16)10-27-19-21-12-22-25-19/h2-9,11-12H,10H2,1H3,(H,21,22,25)(H,23,24,26)