ethyl 2-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(E)-2-cyano-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-p-phenetyl-acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C19H19N3O4S/c1-4-25-15-8-6-13(7-9-15)10-14(11-20)17(23)22-19-21-12(3)16(27-19)18(24)26-5-2/h6-10H,4-5H2,1-3H3,(H,21,22,23)/b14-10+