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

Systemtic Name: ethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O3S/c1-3-24-16(23)14-10(2)20-17(25-14)21-15(22)12(9-19)8-11-4-6-13(18)7-5-11/h4-8H,3H2,1-2H3,(H,20,21,22)/b12-8+