[2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethanoate

Systemtic Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethanoate Openeye Name: [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetic acid [2-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]acetic acid [2-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)COC(=O)CNC2=NS(=O)(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)COC(=O)CNC2=NS(=O)(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H21N3O5S/c1-4-22-12(2)9-15(13(22)3)16(23)11-27-18(24)10-20-19-14-7-5-6-8-17(14)28(25,26)21-19/h5-9H,4,10-11H2,1-3H3,(H,20,21)