ethyl 1-[2-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethoxy]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethoxy]-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethoxy]-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-[2-[(3-cyano-2-thienyl)amino]-2-keto-ethoxy]-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)NC2=C(C=CS2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)OCC(=O)NC2=C(C=CS2)C#N)C

InChI

InChI=1S/C18H19N3O5S/c1-4-25-18(24)14-7-11(2)21(12(14)3)9-16(23)26-10-15(22)20-17-13(8-19)5-6-27-17/h5-7H,4,9-10H2,1-3H3,(H,20,22)