methyl 3-(4-methoxyphenyl)-2-[6-(methylsulfonylamino)-3-oxidanylidene-1,4-benzothiazin-4-yl]propanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)-2-[6-(methylsulfonylamino)-3-oxidanylidene-1,4-benzothiazin-4-yl]propanoate Openeye Name: methyl 2-[6-(methanesulfonamido)-3-oxo-1,4-benzothiazin-4-yl]-3-(4-methoxyphenyl)propanoate CAS Name: 2-[6-(methanesulfonamido)-3-oxo-1,4-benzothiazin-4-yl]-3-(4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[6-(methanesulfonamido)-3-oxo-1,4-benzothiazin-4-yl]-3-(4-methoxyphenyl)propanoate Traditional Name: 2-[3-keto-6-(methanesulfonamido)-1,4-benzothiazin-4-yl]-3-(4-methoxyphenyl)propionic acid methyl ester Formula: C20H22N2O6S2 MolecularWeight: 450.52848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OC)N2C(=O)CSC3=C2C=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OC)N2C(=O)CSC3=C2C=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C20H22N2O6S2/c1-27-15-7-4-13(5-8-15)10-17(20(24)28-2)22-16-11-14(21-30(3,25)26)6-9-18(16)29-12-19(22)23/h4-9,11,17,21H,10,12H2,1-3H3