propan-2-yl 3-hexanoyl-2-phenethyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: propan-2-yl 3-hexanoyl-2-phenethyl-1,3-thiazolidine-4-carboxylate Openeye Name: isopropyl 3-hexanoyl-2-phenethyl-thiazolidine-4-carboxylate CAS Name: 3-(1-oxohexyl)-2-phenethyl-4-thiazolidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-hexanoyl-2-phenethyl-1,3-thiazolidine-4-carboxylate Traditional Name: 3-caproyl-2-phenethyl-thiazolidine-4-carboxylic acid isopropyl ester Formula: C21H31NO3S MolecularWeight: 377.54074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C(CSC1CCC2=CC=CC=C2)C(=O)OC(C)C

Isomeric SMILES

CCCCCC(=O)N1C(CSC1CCC2=CC=CC=C2)C(=O)OC(C)C

InChI

InChI=1S/C21H31NO3S/c1-4-5-7-12-19(23)22-18(21(24)25-16(2)3)15-26-20(22)14-13-17-10-8-6-9-11-17/h6,8-11,16,18,20H,4-5,7,12-15H2,1-3H3