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

Systemtic Name: 3-chloranyl-11-methyl-N-(2-oxidanylbutyl)-9-oxidanylidene-6-thiophen-3-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Openeye Name: 3-chloro-N-(2-hydroxybutyl)-11-methyl-9-oxo-6-(3-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide CAS Name: 3-chloro-N-(2-hydroxybutyl)-11-methyl-9-oxo-6-(3-thiophenyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide IUPAC Name: 3-chloro-N-(2-hydroxybutyl)-11-methyl-9-oxo-6-thiophen-3-yl-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Traditional Name: 3-chloro-N-(2-hydroxybutyl)-9-keto-11-methyl-6-(3-thienyl)-6,7-dihydropyrido[2,1-d][1,5]benzothiazepine-8-carboxamide Formula: C23H23ClN2O3S2 MolecularWeight: 475.02332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C2CC(SC3=C(N2C(=CC1=O)C)C=CC(=C3)Cl)C4=CSC=C4)O

Isomeric SMILES

CCC(CNC(=O)C1=C2CC(SC3=C(N2C(=CC1=O)C)C=CC(=C3)Cl)C4=CSC=C4)O

InChI

InChI=1S/C23H23ClN2O3S2/c1-3-16(27)11-25-23(29)22-18-10-20(14-6-7-30-12-14)31-21-9-15(24)4-5-17(21)26(18)13(2)8-19(22)28/h4-9,12,16,20,27H,3,10-11H2,1-2H3,(H,25,29)