[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl (3R)-3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl (3R)-3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [2-(4-chlorophenyl)thiazol-4-yl]methyl (3R)-3-acetamido-3-(2-thienyl)propanoate CAS Name: (3R)-3-acetamido-3-thiophen-2-ylpropanoic acid [2-(4-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl (3R)-3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: (3R)-3-acetamido-3-(2-thienyl)propionic acid [2-(4-chlorophenyl)thiazol-4-yl]methyl ester Formula: C19H17ClN2O3S2 MolecularWeight: 420.93288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC1=CSC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OCC1=CSC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C19H17ClN2O3S2/c1-12(23)21-16(17-3-2-8-26-17)9-18(24)25-10-15-11-27-19(22-15)13-4-6-14(20)7-5-13/h2-8,11,16H,9-10H2,1H3,(H,21,23)/t16-/m1/s1