1-(3-methoxycarbonyl-2-methyl-5-phenyl-pentanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-methoxycarbonyl-2-methyl-5-phenyl-pentanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-methoxycarbonyl-2-methyl-5-phenyl-pentanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 1-(3-methoxycarbonyl-2-methyl-1-oxo-5-phenylpentyl)-4-(phenylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-methoxycarbonyl-2-methyl-5-phenylpentanoyl)-4-phenylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: 1-(3-carbomethoxy-2-methyl-5-phenyl-pentanoyl)-4-(phenylthio)proline Formula: C25H29NO5S MolecularWeight: 455.56646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC=C1)C(=O)OC)C(=O)N2CC(CC2C(=O)O)SC3=CC=CC=C3

Isomeric SMILES

CC(C(CCC1=CC=CC=C1)C(=O)OC)C(=O)N2CC(CC2C(=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C25H29NO5S/c1-17(21(25(30)31-2)14-13-18-9-5-3-6-10-18)23(27)26-16-20(15-22(26)24(28)29)32-19-11-7-4-8-12-19/h3-12,17,20-22H,13-16H2,1-2H3,(H,28,29)