methyl 3-(4-methoxyphenyl)-2-[7-(methylcarbamoylamino)-3-oxidanylidene-1,4-benzothiazin-4-yl]propanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)-2-[7-(methylcarbamoylamino)-3-oxidanylidene-1,4-benzothiazin-4-yl]propanoate Openeye Name: methyl 3-(4-methoxyphenyl)-2-[7-(methylcarbamoylamino)-3-oxo-1,4-benzothiazin-4-yl]propanoate CAS Name: 3-(4-methoxyphenyl)-2-[7-(methylcarbamoylamino)-3-oxo-1,4-benzothiazin-4-yl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methoxyphenyl)-2-[7-(methylcarbamoylamino)-3-oxo-1,4-benzothiazin-4-yl]propanoate Traditional Name: 2-[3-keto-7-(methylcarbamoylamino)-1,4-benzothiazin-4-yl]-3-(4-methoxyphenyl)propionic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC2=C(C=C1)N(C(=O)CS2)C(CC3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CNC(=O)NC1=CC2=C(C=C1)N(C(=O)CS2)C(CC3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C21H23N3O5S/c1-22-21(27)23-14-6-9-16-18(11-14)30-12-19(25)24(16)17(20(26)29-3)10-13-4-7-15(28-2)8-5-13/h4-9,11,17H,10,12H2,1-3H3,(H2,22,23,27)