[4-[(1Z)-3-azanyl-2,4,4-tricyano-buta-1,3-dienyl]-2-ethoxy-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-[(1Z)-3-azanyl-2,4,4-tricyano-buta-1,3-dienyl]-2-ethoxy-phenyl] thiophene-2-carboxylate Openeye Name: [4-[(1Z)-3-amino-2,4,4-tricyano-buta-1,3-dienyl]-2-ethoxy-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-[(1Z)-3-amino-2,4,4-tricyanobuta-1,3-dienyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(1Z)-3-amino-2,4,4-tricyanobuta-1,3-dienyl]-2-ethoxyphenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-[(1Z)-3-amino-2,4,4-tricyano-buta-1,3-dienyl]-2-ethoxy-phenyl] ester Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=C(C#N)C#N)N)OC(=O)C2=CC=CS2

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=C(C#N)C#N)N)OC(=O)C2=CC=CS2

InChI

InChI=1S/C20H14N4O3S/c1-2-26-17-9-13(8-14(10-21)19(24)15(11-22)12-23)5-6-16(17)27-20(25)18-4-3-7-28-18/h3-9H,2,24H2,1H3/b14-8+