ethyl 2-[[(E)-4-azanyl-3-cyano-4-oxidanylidene-but-2-en-2-yl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(E)-4-azanyl-3-cyano-4-oxidanylidene-but-2-en-2-yl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(E)-3-amino-2-cyano-1-methyl-3-oxo-prop-1-enyl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]-4-methyl-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]-4-methyl-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-amino-2-cyano-3-keto-1-methyl-prop-1-enyl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)NC(=C(C#N)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)N/C(=C(\C#N)/C(=O)N)/C

InChI

InChI=1S/C19H19N3O3S/c1-4-25-19(24)15-11(2)16(13-8-6-5-7-9-13)26-18(15)22-12(3)14(10-20)17(21)23/h5-9,22H,4H2,1-3H3,(H2,21,23)/b14-12+