3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-(phenylmethyl)butanamide

Systemtic Name: 3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide CAS Name: 3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide Traditional Name: N-benzyl-3-[(3-keto-4H-1,4-benzothiazin-6-yl)sulfonyl]butyramide Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC(CC(=O)NCC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C19H20N2O4S2/c1-13(9-18(22)20-11-14-5-3-2-4-6-14)27(24,25)15-7-8-17-16(10-15)21-19(23)12-26-17/h2-8,10,13H,9,11-12H2,1H3,(H,20,22)(H,21,23)