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

Systemtic Name: 3-methyl-4-oxidanylidene-N-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 3-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 3-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 3-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-3-methyl-N-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C17H15F3N2O3S2 MolecularWeight: 416.43781

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Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(F)(F)F)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(F)(F)F)NC1=O

InChI

InChI=1S/C17H15F3N2O3S2/c1-10-9-26-15-6-5-13(8-14(15)21-16(10)23)27(24,25)22-12-4-2-3-11(7-12)17(18,19)20/h2-8,10,22H,9H2,1H3,(H,21,23)