methyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-4-ethyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-4-ethyl-thiazole-5-carboxylate CAS Name: 2-[[3-(3-chlorophenyl)-1-oxoprop-2-enyl]amino]-4-ethyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(3-chlorophenyl)prop-2-enoylamino]-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(3-chlorophenyl)acryloyl]amino]-4-ethyl-thiazole-5-carboxylic acid methyl ester Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NC(=O)C=CC2=CC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

CCC1=C(SC(=N1)NC(=O)C=CC2=CC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C16H15ClN2O3S/c1-3-12-14(15(21)22-2)23-16(18-12)19-13(20)8-7-10-5-4-6-11(17)9-10/h4-9H,3H2,1-2H3,(H,18,19,20)