butyl 3-(3-methylbutanoyl)-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl 3-(3-methylbutanoyl)-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Openeye Name: butyl 3-(3-methylbutanoyl)-2-(3-phenoxyphenyl)thiazolidine-4-carboxylate CAS Name: 3-(3-methyl-1-oxobutyl)-2-(3-phenoxyphenyl)-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl 3-(3-methylbutanoyl)-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-isovaleryl-2-(3-phenoxyphenyl)thiazolidine-4-carboxylic acid butyl ester Formula: C25H31NO4S MolecularWeight: 441.58294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)CC(C)C)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1CSC(N1C(=O)CC(C)C)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H31NO4S/c1-4-5-14-29-25(28)22-17-31-24(26(22)23(27)15-18(2)3)19-10-9-13-21(16-19)30-20-11-7-6-8-12-20/h6-13,16,18,22,24H,4-5,14-15,17H2,1-3H3