O2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-O-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester O4-methyl ester Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N)C)C(=O)OC

InChI

InChI=1S/C17H19N3O6S/c1-4-10-12(16(23)25-3)8(2)13(19-10)17(24)26-7-11(21)20-15-9(14(18)22)5-6-27-15/h5-6,19H,4,7H2,1-3H3,(H2,18,22)(H,20,21)