propan-2-yl 3-[(4-nitrophenyl)carbamoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: propan-2-yl 3-[(4-nitrophenyl)carbamoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate Openeye Name: isopropyl 3-[(4-nitrophenyl)carbamoyl]-2-phenethyl-thiazolidine-4-carboxylate CAS Name: 3-[(4-nitroanilino)-oxomethyl]-2-phenethyl-4-thiazolidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(4-nitrophenyl)carbamoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate Traditional Name: 3-[(4-nitrophenyl)carbamoyl]-2-phenethyl-thiazolidine-4-carboxylic acid isopropyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1CSC(N1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1CSC(N1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5S/c1-15(2)30-21(26)19-14-31-20(13-8-16-6-4-3-5-7-16)24(19)22(27)23-17-9-11-18(12-10-17)25(28)29/h3-7,9-12,15,19-20H,8,13-14H2,1-2H3,(H,23,27)