N-methyl-6-oxidanylidene-5-prop-2-enyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-methyl-6-oxidanylidene-5-prop-2-enyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 5-allyl-N-methyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-methyl-6-oxo-5-prop-2-enyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-methyl-6-oxo-5-prop-2-enylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 5-allyl-6-keto-N-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CNC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C18H16N2O2S/c1-3-10-20-14-11-12(17(21)19-2)8-9-16(14)23-15-7-5-4-6-13(15)18(20)22/h3-9,11H,1,10H2,2H3,(H,19,21)