[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CSC(=N2)NCC=C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)C2=CSC(=N2)NCC=C

InChI

InChI=1S/C17H18N2O3S/c1-3-9-18-17-19-14(11-23-17)16(21)22-10-15(20)13-7-5-12(4-2)6-8-13/h3,5-8,11H,1,4,9-10H2,2H3,(H,18,19)