ethyl 4-[[(5S)-2-[(4-ethylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[(5S)-2-[(4-ethylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-yl]methyl]benzoate Openeye Name: ethyl 4-[[(5S)-2-(4-ethylanilino)-4-oxo-thiazol-5-yl]methyl]benzoate CAS Name: 4-[[(5S)-2-(4-ethylanilino)-4-oxo-5-thiazolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(5S)-2-(4-ethylanilino)-4-oxo-1,3-thiazol-5-yl]methyl]benzoate Traditional Name: 4-[[(5S)-2-(4-ethylanilino)-4-keto-2-thiazolin-5-yl]methyl]benzoic acid ethyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=O)C(S2)CC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=O)[C@@H](S2)CC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C21H22N2O3S/c1-3-14-7-11-17(12-8-14)22-21-23-19(24)18(27-21)13-15-5-9-16(10-6-15)20(25)26-4-2/h5-12,18H,3-4,13H2,1-2H3,(H,22,23,24)/t18-/m0/s1