N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[2-(3,5-dimethyl-1-pyrazolyl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)SCC(=O)N4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)SCC(=O)N4)C

InChI

InChI=1S/C20H18N4O2S/c1-12-9-13(2)24(23-12)17-6-4-3-5-15(17)22-20(26)14-7-8-18-16(10-14)21-19(25)11-27-18/h3-10H,11H2,1-2H3,(H,21,25)(H,22,26)