4-(3-methylphenyl)-3-(5-propan-2-ylthiophen-3-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-methylphenyl)-3-(5-propan-2-ylthiophen-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-isopropyl-3-thienyl)-4-(m-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-methylphenyl)-3-(5-propan-2-yl-3-thiophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-methylphenyl)-3-(5-propan-2-ylthiophen-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-isopropyl-3-thienyl)-4-(m-tolyl)-1H-1,2,4-triazole-5-thione Formula: C16H17N3S2 MolecularWeight: 315.45628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NNC2=S)C3=CSC(=C3)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NNC2=S)C3=CSC(=C3)C(C)C

InChI

InChI=1S/C16H17N3S2/c1-10(2)14-8-12(9-21-14)15-17-18-16(20)19(15)13-6-4-5-11(3)7-13/h4-10H,1-3H3,(H,18,20)