N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[(6S)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C19H24N4OS2 MolecularWeight: 388.55006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C19H24N4OS2/c1-19(2,3)12-5-6-13-14(10-20)17(26-15(13)9-12)22-16(24)11-25-18-21-7-8-23(18)4/h7-8,12H,5-6,9,11H2,1-4H3,(H,22,24)/t12-/m0/s1