5-ethoxycarbonyl-4-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinatoamino)phenyl]phenyl]methyl]imidazole

Systemtic Name: 5-ethoxycarbonyl-4-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinatoamino)phenyl]phenyl]methyl]imidazole Openeye Name: 5-ethoxycarbonyl-4-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinatoamino)phenyl]phenyl]methyl]imidazole CAS Name: 5-ethoxycarbonyl-4-(methylthio)-2-propyl-1-[[4-[2-(sulfinatoamino)phenyl]phenyl]methyl]imidazole IUPAC Name: 5-ethoxycarbonyl-4-methylsulfanyl-2-propyl-1-[[4-[2-(sulfinatoamino)phenyl]phenyl]methyl]imidazole Traditional Name: 5-carbethoxy-4-(methylthio)-2-propyl-1-[4-[2-(sulfinatoamino)phenyl]benzyl]imidazole Formula: C23H26N3O4S2- MolecularWeight: 472.60024

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)[O-])C(=O)OCC)SC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3NS(=O)[O-])C(=O)OCC)SC

InChI

InChI=1S/C23H27N3O4S2/c1-4-8-20-24-22(31-3)21(23(27)30-5-2)26(20)15-16-11-13-17(14-12-16)18-9-6-7-10-19(18)25-32(28)29/h6-7,9-14,25H,4-5,8,15H2,1-3H3,(H,28,29)/p-1