3-(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(6-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-3-yl)-4-isobutyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(6-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-3-yl)-4-isobutyl-1H-1,2,4-triazole-5-thione Formula: C18H27N3S2 MolecularWeight: 349.55708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NNC1=S)C2=CSC3=C2CCC(C3)C(C)(C)C

Isomeric SMILES

CC(C)CN1C(=NNC1=S)C2=CSC3=C2CCC(C3)C(C)(C)C

InChI

InChI=1S/C18H27N3S2/c1-11(2)9-21-16(19-20-17(21)22)14-10-23-15-8-12(18(3,4)5)6-7-13(14)15/h10-12H,6-9H2,1-5H3,(H,20,22)