3-[5-[[2-butyl-3-[(4-methoxycarbonylphenyl)methyl]imidazol-4-yl]methyl]thiophen-2-yl]-2-sulfanylidene-propanoic acid

Systemtic Name: 3-[5-[[2-butyl-3-[(4-methoxycarbonylphenyl)methyl]imidazol-4-yl]methyl]thiophen-2-yl]-2-sulfanylidene-propanoic acid Openeye Name: 3-[5-[[2-butyl-3-[(4-methoxycarbonylphenyl)methyl]imidazol-4-yl]methyl]-2-thienyl]-2-thioxo-propanoic acid CAS Name: 3-[5-[[2-butyl-3-[(4-methoxycarbonylphenyl)methyl]-4-imidazolyl]methyl]-2-thiophenyl]-2-sulfanylidenepropanoic acid IUPAC Name: 3-[5-[[2-butyl-3-[(4-methoxycarbonylphenyl)methyl]imidazol-4-yl]methyl]thiophen-2-yl]-2-sulfanylidenepropanoic acid Traditional Name: 3-[5-[[2-butyl-3-(4-carbomethoxybenzyl)imidazol-4-yl]methyl]-2-thienyl]-2-thioxo-propionic acid Formula: C24H26N2O4S2 MolecularWeight: 470.60424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OC)CC3=CC=C(S3)CC(=S)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)OC)CC3=CC=C(S3)CC(=S)C(=O)O

InChI

InChI=1S/C24H26N2O4S2/c1-3-4-5-22-25-14-18(12-19-10-11-20(32-19)13-21(31)23(27)28)26(22)15-16-6-8-17(9-7-16)24(29)30-2/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,27,28)