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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

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