2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazole

Systemtic Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazole Openeye Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazole CAS Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-[4-(phenylthio)phenyl]-1H-imidazole IUPAC Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazole Traditional Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenyl-5-[4-(phenylthio)phenyl]-1H-imidazole Formula: C29H22N2O3S MolecularWeight: 478.56158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3=NC(=C(N3)C4=CC=C(C=C4)SC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C3=NC(=C(N3)C4=CC=C(C=C4)SC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H22N2O3S/c1-32-24-16-21(17-25-28(24)34-18-33-25)29-30-26(19-8-4-2-5-9-19)27(31-29)20-12-14-23(15-13-20)35-22-10-6-3-7-11-22/h2-17H,18H2,1H3,(H,30,31)