methyl 9-azanyl-6-cyano-7-(4-methylphenyl)-11-oxidanylidene-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylate

Systemtic Name: methyl 9-azanyl-6-cyano-7-(4-methylphenyl)-11-oxidanylidene-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylate Openeye Name: methyl 9-amino-6-cyano-11-oxo-7-(p-tolyl)-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylate CAS Name: 9-amino-6-cyano-7-(4-methylphenyl)-11-oxo-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylic acid methyl ester IUPAC Name: methyl 9-amino-6-cyano-7-(4-methylphenyl)-11-oxo-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylate Traditional Name: 9-amino-6-cyano-11-keto-7-(p-tolyl)-7H-pyrido[2,1-b][1,3]benzothiazine-8-carboxylic acid methyl ester Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C3N(C(=C2C(=O)OC)N)C(=O)C4=CC=CC=C4S3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C3N(C(=C2C(=O)OC)N)C(=O)C4=CC=CC=C4S3)C#N

InChI

InChI=1S/C22H17N3O3S/c1-12-7-9-13(10-8-12)17-15(11-23)21-25(19(24)18(17)22(27)28-2)20(26)14-5-3-4-6-16(14)29-21/h3-10,17H,24H2,1-2H3