3-chloranyl-11-methyl-N-(2-methylpropyl)-9-oxidanylidene-6-thiophen-2-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide

Systemtic Name: 3-chloranyl-11-methyl-N-(2-methylpropyl)-9-oxidanylidene-6-thiophen-2-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Openeye Name: 3-chloro-N-isobutyl-11-methyl-9-oxo-6-(2-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide CAS Name: 3-chloro-11-methyl-N-(2-methylpropyl)-9-oxo-6-thiophen-2-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide IUPAC Name: 3-chloro-11-methyl-N-(2-methylpropyl)-9-oxo-6-thiophen-2-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Traditional Name: 3-chloro-N-isobutyl-9-keto-11-methyl-6-(2-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Formula: C23H23ClN2O2S2 MolecularWeight: 459.02392

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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=CS4)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC(=O)C(=C2N1C3=C(C=C(C=C3)Cl)SC(C2)C4=CC=CS4)C(=O)NCC(C)C

InChI

InChI=1S/C23H23ClN2O2S2/c1-13(2)12-25-23(28)22-17-11-21(19-5-4-8-29-19)30-20-10-15(24)6-7-16(20)26(17)14(3)9-18(22)27/h4-10,13,21H,11-12H2,1-3H3,(H,25,28)