N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(phenylcarbonyl)benzamide

Systemtic Name: N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(phenylcarbonyl)benzamide Openeye Name: 2-benzoyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide CAS Name: 2-benzoyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide IUPAC Name: 2-benzoyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Traditional Name: 2-benzoyl-N-[(6R)-6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=CC=C3C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O2S/c1-27(2,3)18-13-14-19-22(16-28)26(32-23(19)15-18)29-25(31)21-12-8-7-11-20(21)24(30)17-9-5-4-6-10-17/h4-12,18H,13-15H2,1-3H3,(H,29,31)/t18-/m1/s1