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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CC(C)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3)C

InChI

InChI=1S/C21H24N2O4S2/c1-4-15-7-5-6-13(2)21(15)23-19(24)10-14(3)29(26,27)16-8-9-18-17(11-16)22-20(25)12-28-18/h5-9,11,14H,4,10,12H2,1-3H3,(H,22,25)(H,23,24)