6-(3,4-dichlorophenyl)-N-methoxy-N-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6-(3,4-dichlorophenyl)-N-methoxy-N-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6-(3,4-dichlorophenyl)-N-methoxy-N-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-(3,4-dichlorophenyl)-N-methoxy-N-methyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 6-(3,4-dichlorophenyl)-N-methoxy-N-methylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-(3,4-dichlorophenyl)-N-methoxy-N-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C22H16Cl2N2O2S MolecularWeight: 443.34564

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=N2)C4=CC(=C(C=C4)Cl)Cl)OC

Isomeric SMILES

CN(C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=N2)C4=CC(=C(C=C4)Cl)Cl)OC

InChI

InChI=1S/C22H16Cl2N2O2S/c1-26(28-2)22(27)14-8-10-20-18(12-14)25-21(13-7-9-16(23)17(24)11-13)15-5-3-4-6-19(15)29-20/h3-12H,1-2H3