N-(3-ethoxypropyl)-5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-(3-ethoxypropyl)-5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-(3-ethoxypropyl)-5-ethyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-(3-ethoxypropyl)-5-ethyl-6-oxo-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-(3-ethoxypropyl)-5-ethyl-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-(3-ethoxypropyl)-5-ethyl-6-keto-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=O)NCCCOCC)SC3=CC=CC=C3C1=O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=O)NCCCOCC)SC3=CC=CC=C3C1=O

InChI

InChI=1S/C21H24N2O3S/c1-3-23-17-14-15(20(24)22-12-7-13-26-4-2)10-11-19(17)27-18-9-6-5-8-16(18)21(23)25/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3,(H,22,24)