ethyl 4-[[(2E)-2-[(3-methylphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[(2E)-2-[(3-methylphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2E)-2-(m-tolylmethylene)-3-oxo-4H-1,4-benzothiazine-6-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[(2E)-2-[(3-methylphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2E)-2-[(3-methylphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[(2E)-3-keto-2-(3-methylbenzylidene)-4H-1,4-benzothiazine-6-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H25N3O4S MolecularWeight: 451.538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)C)C(=O)N3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)S/C(=C/C4=CC(=CC=C4)C)/C(=O)N3

InChI

InChI=1S/C24H25N3O4S/c1-3-31-24(30)27-11-9-26(10-12-27)23(29)18-7-8-20-19(15-18)25-22(28)21(32-20)14-17-6-4-5-16(2)13-17/h4-8,13-15H,3,9-12H2,1-2H3,(H,25,28)/b21-14+