[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl (3R)-3-phenylbutanoate

Systemtic Name: [2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl (3R)-3-phenylbutanoate Openeye Name: [2-(N-acetylanilino)thiazol-4-yl]methyl (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-(N-acetylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-(N-acetylanilino)thiazol-4-yl]methyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3S/c1-16(18-9-5-3-6-10-18)13-21(26)27-14-19-15-28-22(23-19)24(17(2)25)20-11-7-4-8-12-20/h3-12,15-16H,13-14H2,1-2H3/t16-/m1/s1