(E)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-N-(2-thiophen-2-ylethyl)prop-2-enamide

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-N-(2-thiophen-2-ylethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[2-(2-thienyl)ethyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(2-thiophen-2-ylethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(2-thiophen-2-ylethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[2-(2-thienyl)ethyl]acrylamide Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

InChI

InChI=1S/C16H14N2O3S/c17-10-12(8-11-3-4-14(19)15(20)9-11)16(21)18-6-5-13-2-1-7-22-13/h1-4,7-9,19-20H,5-6H2,(H,18,21)/b12-8+