3-(4-chlorophenyl)-4-(4-methylphenyl)-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-4-(4-methylphenyl)-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-(p-tolyl)-5-(2-thienylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-(4-methylphenyl)-5-(thiophen-2-ylmethylthio)-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-(4-methylphenyl)-5-(thiophen-2-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-(p-tolyl)-5-(2-thenylthio)-1,2,4-triazole Formula: C20H16ClN3S2 MolecularWeight: 397.94414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN3S2/c1-14-4-10-17(11-5-14)24-19(15-6-8-16(21)9-7-15)22-23-20(24)26-13-18-3-2-12-25-18/h2-12H,13H2,1H3