2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-propylsulfanyl-pent-4-enoic acid

Systemtic Name: 2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-propylsulfanyl-pent-4-enoic acid Openeye Name: 2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-propylsulfanyl-pent-4-enoic acid CAS Name: 2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-(propylthio)-4-pentenoic acid IUPAC Name: 2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-propylsulfanylpent-4-enoic acid Traditional Name: 2-[2-(2-chlorophenyl)-1-(1H-imidazol-5-yl)ethyl]-2-(propylthio)pent-4-enoic acid Formula: C19H23ClN2O2S MolecularWeight: 378.91612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC(CC=C)(C(CC1=CC=CC=C1Cl)C2=CN=CN2)C(=O)O

Isomeric SMILES

CCCSC(CC=C)(C(CC1=CC=CC=C1Cl)C2=CN=CN2)C(=O)O

InChI

InChI=1S/C19H23ClN2O2S/c1-3-9-19(18(23)24,25-10-4-2)15(17-12-21-13-22-17)11-14-7-5-6-8-16(14)20/h3,5-8,12-13,15H,1,4,9-11H2,2H3,(H,21,22)(H,23,24)