3-chloranyl-11-methyl-9-oxidanylidene-6-phenyl-N-(pyridin-3-ylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide

Systemtic Name: 3-chloranyl-11-methyl-9-oxidanylidene-6-phenyl-N-(pyridin-3-ylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Openeye Name: 3-chloro-11-methyl-9-oxo-6-phenyl-N-(3-pyridylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide CAS Name: 3-chloro-11-methyl-9-oxo-6-phenyl-N-(3-pyridinylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide IUPAC Name: 3-chloro-11-methyl-9-oxo-6-phenyl-N-(pyridin-3-ylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Traditional Name: 3-chloro-9-keto-11-methyl-6-phenyl-N-(3-pyridylmethyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Formula: C27H22ClN3O2S MolecularWeight: 488.00048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C2N1C3=C(C=C(C=C3)Cl)SC(C2)C4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC1=CC(=O)C(=C2N1C3=C(C=C(C=C3)Cl)SC(C2)C4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H22ClN3O2S/c1-17-12-23(32)26(27(33)30-16-18-6-5-11-29-15-18)22-14-24(19-7-3-2-4-8-19)34-25-13-20(28)9-10-21(25)31(17)22/h2-13,15,24H,14,16H2,1H3,(H,30,33)