2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-7-(propan-2-ylcarbamoyl)-1,4-benzothiazin-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-7-(propan-2-ylcarbamoyl)-1,4-benzothiazin-4-yl]ethanoic acid Openeye Name: 2-[7-(isopropylcarbamoyl)-2-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzothiazin-4-yl]acetic acid CAS Name: 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-7-[oxo-(propan-2-ylamino)methyl]-1,4-benzothiazin-4-yl]acetic acid IUPAC Name: 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-7-(propan-2-ylcarbamoyl)-1,4-benzothiazin-4-yl]acetic acid Traditional Name: 2-[7-(isopropylcarbamoyl)-3-keto-2-p-anisyl-1,4-benzothiazin-4-yl]acetic acid Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C1)N(C(=O)C(S2)CC3=CC=C(C=C3)OC)CC(=O)O

Isomeric SMILES

CC(C)NC(=O)C1=CC2=C(C=C1)N(C(=O)C(S2)CC3=CC=C(C=C3)OC)CC(=O)O

InChI

InChI=1S/C22H24N2O5S/c1-13(2)23-21(27)15-6-9-17-18(11-15)30-19(22(28)24(17)12-20(25)26)10-14-4-7-16(29-3)8-5-14/h4-9,11,13,19H,10,12H2,1-3H3,(H,23,27)(H,25,26)