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

Systemtic Name: 1-(4-methylphenyl)-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 2-[[4-(m-tolyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(p-tolyl)ethanone CAS Name: 1-(4-methylphenyl)-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-methylphenyl)-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 2-[[4-(m-tolyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-1-(p-tolyl)ethanone Formula: C22H19N3OS2 MolecularWeight: 405.53576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4=CC=CS4

InChI

InChI=1S/C22H19N3OS2/c1-15-8-10-17(11-9-15)19(26)14-28-22-24-23-21(20-7-4-12-27-20)25(22)18-6-3-5-16(2)13-18/h3-13H,14H2,1-2H3