4-[(2-methylphenyl)methyl]-3-oxidanylidene-N-(pyridin-2-ylmethyl)-1,4-benzothiazine-6-carboxamide

Systemtic Name: 4-[(2-methylphenyl)methyl]-3-oxidanylidene-N-(pyridin-2-ylmethyl)-1,4-benzothiazine-6-carboxamide Openeye Name: 4-(o-tolylmethyl)-3-oxo-N-(2-pyridylmethyl)-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2-methylphenyl)methyl]-3-oxo-N-(2-pyridinylmethyl)-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2-methylphenyl)methyl]-3-oxo-N-(pyridin-2-ylmethyl)-1,4-benzothiazine-6-carboxamide Traditional Name: 3-keto-4-(2-methylbenzyl)-N-(2-pyridylmethyl)-1,4-benzothiazine-6-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H21N3O2S/c1-16-6-2-3-7-18(16)14-26-20-12-17(9-10-21(20)29-15-22(26)27)23(28)25-13-19-8-4-5-11-24-19/h2-12H,13-15H2,1H3,(H,25,28)