(2Z)-N-(2-cyanoethyl)-N-methyl-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: (2Z)-N-(2-cyanoethyl)-N-methyl-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazine-6-carboxamide Openeye Name: (2Z)-2-benzylidene-N-(2-cyanoethyl)-N-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: (2Z)-N-(2-cyanoethyl)-N-methyl-3-oxo-2-(phenylmethylene)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: (2Z)-2-benzylidene-N-(2-cyanoethyl)-N-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: (2Z)-2-benzal-N-(2-cyanoethyl)-3-keto-N-methyl-4H-1,4-benzothiazine-6-carboxamide Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)C1=CC2=C(C=C1)SC(=CC3=CC=CC=C3)C(=O)N2

Isomeric SMILES

CN(CCC#N)C(=O)C1=CC2=C(C=C1)S/C(=C\C3=CC=CC=C3)/C(=O)N2

InChI

InChI=1S/C20H17N3O2S/c1-23(11-5-10-21)20(25)15-8-9-17-16(13-15)22-19(24)18(26-17)12-14-6-3-2-4-7-14/h2-4,6-9,12-13H,5,11H2,1H3,(H,22,24)/b18-12-