N-[6-(dimethylamino)pyridin-3-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[6-(dimethylamino)-3-pyridyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[6-(dimethylamino)pyridin-3-yl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[6-(dimethylamino)-3-pyridyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

CN(C)C1=NC=C(C=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C17H18N4O2S/c1-21(2)15-6-4-12(10-18-15)19-17(23)11-3-5-14-13(9-11)20-16(22)7-8-24-14/h3-6,9-10H,7-8H2,1-2H3,(H,19,23)(H,20,22)