4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(5-piperidin-1-ylisoquinolin-8-yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-[5-(1-piperidyl)-8-isoquinolyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-[5-(1-piperidinyl)-8-isoquinolinyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(5-piperidin-1-ylisoquinolin-8-yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-(5-piperidino-8-isoquinolyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4=CC5=C(C=C4)SCCC(=O)N5

InChI

InChI=1S/C24H24N4O2S/c29-23-9-13-31-22-7-4-16(14-20(22)26-23)24(30)27-19-5-6-21(28-11-2-1-3-12-28)17-8-10-25-15-18(17)19/h4-8,10,14-15H,1-3,9,11-13H2,(H,26,29)(H,27,30)