3-[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-isopropyl-3-[(6R)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-3-yl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(6R)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-4-propan-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-isopropyl-3-[(6R)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-3-yl]-1H-1,2,4-triazole-5-thione Formula: C14H19N3S2 MolecularWeight: 293.45076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C3=NNC(=S)N3C(C)C

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC=C2C3=NNC(=S)N3C(C)C

InChI

InChI=1S/C14H19N3S2/c1-8(2)17-13(15-16-14(17)18)11-7-19-12-6-9(3)4-5-10(11)12/h7-9H,4-6H2,1-3H3,(H,16,18)/t9-/m1/s1