N-[4-(3-methylbutanoylamino)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C20H21N3O3S/c1-12(2)9-18(24)21-14-4-6-15(7-5-14)22-20(26)13-3-8-17-16(10-13)23-19(25)11-27-17/h3-8,10,12H,9,11H2,1-2H3,(H,21,24)(H,22,26)(H,23,25)