O4-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] O1-ethyl but-2-enedioate

Systemtic Name: O4-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] O1-ethyl but-2-enedioate Openeye Name: O4-[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] O1-ethyl but-2-enedioate CAS Name: 2-butenedioic acid O4-[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 1-O-ethyl but-2-enedioate Traditional Name: but-2-enedioic acid O4-[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester O1-ethyl ester Formula: C13H12N2O5S MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)NC1=C(C=CS1)C#N

Isomeric SMILES

CCOC(=O)C=CC(=O)OCC(=O)NC1=C(C=CS1)C#N

InChI

InChI=1S/C13H12N2O5S/c1-2-19-11(17)3-4-12(18)20-8-10(16)15-13-9(7-14)5-6-21-13/h3-6H,2,8H2,1H3,(H,15,16)