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

Systemtic Name: 5-methyl-6-oxidanylidene-N-(phenylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-benzyl-5-methyl-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 5-methyl-6-oxo-N-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-benzyl-5-methyl-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-benzyl-6-keto-5-methyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C22H18N2O2S MolecularWeight: 374.45552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCC3=CC=CC=C3)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C22H18N2O2S/c1-24-18-13-16(21(25)23-14-15-7-3-2-4-8-15)11-12-20(18)27-19-10-6-5-9-17(19)22(24)26/h2-13H,14H2,1H3,(H,23,25)