N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[1-(3-fluoranyl-4-methoxy-phenyl)ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[1-(3-fluoro-4-methoxy-phenyl)ethyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C19H19FN2O3S MolecularWeight: 374.429163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)F)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)F)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C19H19FN2O3S/c1-11(12-3-5-16(25-2)14(20)9-12)21-19(24)13-4-6-17-15(10-13)22-18(23)7-8-26-17/h3-6,9-11H,7-8H2,1-2H3,(H,21,24)(H,22,23)