4-ethoxycarbonyloxy-5-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinoamino)phenyl]phenyl]methyl]imidazole

Systemtic Name: 4-ethoxycarbonyloxy-5-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinoamino)phenyl]phenyl]methyl]imidazole Openeye Name: 4-ethoxycarbonyloxy-5-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinoamino)phenyl]phenyl]methyl]imidazole CAS Name: 4-ethoxycarbonyloxy-5-(methylthio)-2-propyl-1-[[4-[2-(sulfinoamino)phenyl]phenyl]methyl]imidazole IUPAC Name: 4-ethoxycarbonyloxy-5-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinoamino)phenyl]phenyl]methyl]imidazole Traditional Name: 4-carbethoxyoxy-5-(methylthio)-2-propyl-1-[4-[2-(sulfinoamino)phenyl]benzyl]imidazole Formula: C23H27N3O5S2 MolecularWeight: 489.60758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)O)SC)OC(=O)OCC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)O)SC)OC(=O)OCC

InChI

InChI=1S/C23H27N3O5S2/c1-4-8-20-24-21(31-23(27)30-5-2)22(32-3)26(20)15-16-11-13-17(14-12-16)18-9-6-7-10-19(18)25-33(28)29/h6-7,9-14,25H,4-5,8,15H2,1-3H3,(H,28,29)