8-chloranyl-N-(3-methoxypropyl)-6-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 8-chloranyl-N-(3-methoxypropyl)-6-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 8-chloro-N-(3-methoxypropyl)-6-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 8-chloro-N-(3-methoxypropyl)-6-methyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 8-chloro-N-(3-methoxypropyl)-6-methylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 8-chloro-N-(3-methoxypropyl)-6-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C(=O)NCCCOC)SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C(=O)NCCCOC)SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN2O2S/c1-12-15-11-14(20)5-7-17(15)25-18-6-4-13(10-16(18)22-12)19(23)21-8-3-9-24-2/h4-7,10-11H,3,8-9H2,1-2H3,(H,21,23)