N-[2-(4-chlorophenyl)ethyl]-3-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-3-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-3-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-keto-3-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C18H19ClN2O3S2 MolecularWeight: 410.93806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NCCC3=CC=C(C=C3)Cl)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NCCC3=CC=C(C=C3)Cl)NC1=O

InChI

InChI=1S/C18H19ClN2O3S2/c1-12-11-25-17-7-6-15(10-16(17)21-18(12)22)26(23,24)20-9-8-13-2-4-14(19)5-3-13/h2-7,10,12,20H,8-9,11H2,1H3,(H,21,22)