3-cyclopropyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-cyclopropyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-cyclopropyl-4-(m-tolyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclopropyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-cyclopropyl-4-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-cyclopropyl-5-[(4-methylbenzyl)thio]-4-(m-tolyl)-1,2,4-triazole Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC(=C3)C)C4CC4

InChI

InChI=1S/C20H21N3S/c1-14-6-8-16(9-7-14)13-24-20-22-21-19(17-10-11-17)23(20)18-5-3-4-15(2)12-18/h3-9,12,17H,10-11,13H2,1-2H3