N-cyclopentyl-2-methyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: N-cyclopentyl-2-methyl-4-oxidanylidene-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-cyclopentyl-2-methyl-4-oxo-N-(2-thienylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-cyclopentyl-2-methyl-4-oxo-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-cyclopentyl-2-methyl-4-oxo-N-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-cyclopentyl-4-keto-2-methyl-N-(2-thenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C20H24N2O3S3 MolecularWeight: 436.61116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CS3)C4CCCC4

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CS3)C4CCCC4

InChI

InChI=1S/C20H24N2O3S3/c1-14-11-20(23)21-18-12-17(8-9-19(18)27-14)28(24,25)22(15-5-2-3-6-15)13-16-7-4-10-26-16/h4,7-10,12,14-15H,2-3,5-6,11,13H2,1H3,(H,21,23)