N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylsulfonyl)benzenesulfonamide Openeye Name: N-(benzenesulfonyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzenesulfonamide CAS Name: N-(benzenesulfonyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzenesulfonamide IUPAC Name: N-(benzenesulfonyl)-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzenesulfonamide Traditional Name: N-besyl-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzenesulfonamide Formula: C25H26N2O4S3 MolecularWeight: 514.67994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O4S3/c1-25(2,3)18-14-15-21-22(17-26)24(32-23(21)16-18)27(33(28,29)19-10-6-4-7-11-19)34(30,31)20-12-8-5-9-13-20/h4-13,18H,14-16H2,1-3H3