1-[2-(4-chlorophenyl)-4-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[2-(4-chlorophenyl)-4-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[2-(4-chlorophenyl)-4-(p-tolyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[2-(4-chlorophenyl)-4-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[2-(4-chlorophenyl)-4-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[2-(4-chlorophenyl)-4-(p-tolyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone Formula: C21H18ClN3OS MolecularWeight: 395.90512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C21H18ClN3OS/c1-14-5-9-17(10-6-14)24-20(15(2)26)23-25(18-11-7-16(22)8-12-18)21(24)19-4-3-13-27-19/h3-13,21H,1-2H3