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

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[(E)-2-cyano-3-phenyl-prop-2-enoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-phenylprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-phenylprop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-phenyl-acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H15N3O3S MolecularWeight: 341.3843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C(=CC2=CC=CC=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)/C(=C/C2=CC=CC=C2)/C#N)C

InChI

InChI=1S/C17H15N3O3S/c1-3-23-16(22)14-11(2)19-17(24-14)20-15(21)13(10-18)9-12-7-5-4-6-8-12/h4-9H,3H2,1-2H3,(H,19,20,21)/b13-9+