methyl 2,4-dimethyl-5-[2-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[1-oxo-2-(3-oxo-4H-1,4-benzothiazin-2-yl)ethoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[2-(3-keto-4H-1,4-benzothiazin-2-yl)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C21H22N2O6S/c1-10-17(21(27)28-4)11(2)22-18(10)19(25)12(3)29-16(24)9-15-20(26)23-13-7-5-6-8-14(13)30-15/h5-8,12,15,22H,9H2,1-4H3,(H,23,26)