ethyl 2-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylethanoate Openeye Name: ethyl 2-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxo-1-sulfanyl-prop-1-enyl]sulfanylacetate CAS Name: 2-[[(E)-2-cyano-1-mercapto-3-(4-methoxyanilino)-3-oxoprop-1-enyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxo-1-sulfanylprop-1-enyl]sulfanylacetate Traditional Name: 2-[[(E)-2-cyano-3-keto-1-mercapto-3-(p-anisidino)prop-1-enyl]thio]acetic acid ethyl ester Formula: C15H16N2O4S2 MolecularWeight: 352.42854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=C(C#N)C(=O)NC1=CC=C(C=C1)OC)S

Isomeric SMILES

CCOC(=O)CS/C(=C(\C#N)/C(=O)NC1=CC=C(C=C1)OC)/S

InChI

InChI=1S/C15H16N2O4S2/c1-3-21-13(18)9-23-15(22)12(8-16)14(19)17-10-4-6-11(20-2)7-5-10/h4-7,22H,3,9H2,1-2H3,(H,17,19)/b15-12+