8-chloranyl-N-(2-methoxyethyl)-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 8-chloranyl-N-(2-methoxyethyl)-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 8-chloro-N-(2-methoxyethyl)-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 8-chloro-N-(2-methoxyethyl)-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: 8-chloro-N-(2-methoxyethyl)-6-methylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 8-chloro-N-(2-methoxyethyl)-6-methylene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C18H17ClN2O2S MolecularWeight: 360.85778

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(=C)N2

Isomeric SMILES

COCCNC(=O)C1=CC2=C(C=C1)SC3=C(C=C(C=C3)Cl)C(=C)N2

InChI

InChI=1S/C18H17ClN2O2S/c1-11-14-10-13(19)4-6-16(14)24-17-5-3-12(9-15(17)21-11)18(22)20-7-8-23-2/h3-6,9-10,21H,1,7-8H2,2H3,(H,20,22)