butyl 2-(2-methylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl 2-(2-methylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-1,3-thiazolidine-4-carboxylate Openeye Name: butyl 2-isobutyl-3-[(E)-3-phenylprop-2-enoyl]thiazolidine-4-carboxylate CAS Name: 2-(2-methylpropyl)-3-[(E)-1-oxo-3-phenylprop-2-enyl]-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl 2-(2-methylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 2-isobutyl-3-[(E)-3-phenylacryloyl]thiazolidine-4-carboxylic acid butyl ester Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C=CC2=CC=CC=C2)CC(C)C

Isomeric SMILES

CCCCOC(=O)C1CSC(N1C(=O)/C=C/C2=CC=CC=C2)CC(C)C

InChI

InChI=1S/C21H29NO3S/c1-4-5-13-25-21(24)18-15-26-20(14-16(2)3)22(18)19(23)12-11-17-9-7-6-8-10-17/h6-12,16,18,20H,4-5,13-15H2,1-3H3/b12-11+