N-[2-(4-methylphenyl)ethyl]-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide

Systemtic Name: N-[2-(4-methylphenyl)ethyl]-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide Openeye Name: 3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-[2-(p-tolyl)ethyl]butanamide CAS Name: N-[2-(4-methylphenyl)ethyl]-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide IUPAC Name: N-[2-(4-methylphenyl)ethyl]-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]butanamide Traditional Name: 3-[(3-keto-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-[2-(p-tolyl)ethyl]butyramide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)CCNC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C21H24N2O4S2/c1-14-3-5-16(6-4-14)9-10-22-20(24)11-15(2)29(26,27)17-7-8-19-18(12-17)23-21(25)13-28-19/h3-8,12,15H,9-11,13H2,1-2H3,(H,22,24)(H,23,25)