2-methylpropyl 3-heptanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-heptanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-heptanoyl-2-phenyl-thiazolidine-4-carboxylate CAS Name: 3-(1-oxoheptyl)-2-phenyl-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-heptanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Traditional Name: 3-enanthyl-2-phenyl-thiazolidine-4-carboxylic acid isobutyl ester Formula: C21H31NO3S MolecularWeight: 377.54074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)OCC(C)C

Isomeric SMILES

CCCCCCC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)OCC(C)C

InChI

InChI=1S/C21H31NO3S/c1-4-5-6-10-13-19(23)22-18(21(24)25-14-16(2)3)15-26-20(22)17-11-8-7-9-12-17/h7-9,11-12,16,18,20H,4-6,10,13-15H2,1-3H3