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

Systemtic Name: 3-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-methyl-1H-1,2,4-triazole-5-thione Formula: C15H21N3S2 MolecularWeight: 307.47734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C3=NNC(=S)N3C

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C3=NNC(=S)N3C

InChI

InChI=1S/C15H21N3S2/c1-15(2,3)10-5-6-11-9(7-10)8-12(20-11)13-16-17-14(19)18(13)4/h8,10H,5-7H2,1-4H3,(H,17,19)