2-[[[1-(1,3-benzodioxol-5-ylmethyl)-3-butyl-2-phenyl-2H-imidazol-4-yl]methylamino]methyl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 2-[[[1-(1,3-benzodioxol-5-ylmethyl)-3-butyl-2-phenyl-2H-imidazol-4-yl]methylamino]methyl]cyclohexa-2,4-diene-1-thione Openeye Name: 2-[[[1-(1,3-benzodioxol-5-ylmethyl)-3-butyl-2-phenyl-2H-imidazol-4-yl]methylamino]methyl]cyclohexa-2,4-diene-1-thione CAS Name: 2-[[[1-(1,3-benzodioxol-5-ylmethyl)-3-butyl-2-phenyl-2H-imidazol-4-yl]methylamino]methyl]-1-cyclohexa-2,4-dienethione IUPAC Name: 2-[[[1-(1,3-benzodioxol-5-ylmethyl)-3-butyl-2-phenyl-2H-imidazol-4-yl]methylamino]methyl]cyclohexa-2,4-diene-1-thione Traditional Name: 2-[[(3-butyl-2-phenyl-1-piperonyl-4-imidazolin-4-yl)methylamino]methyl]cyclohexa-2,4-diene-1-thione Formula: C29H33N3O2S MolecularWeight: 487.65622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(N(C=C1CNCC2=CC=CCC2=S)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(N(C=C1CNCC2=CC=CCC2=S)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C29H33N3O2S/c1-2-3-15-32-25(18-30-17-24-11-7-8-12-28(24)35)20-31(29(32)23-9-5-4-6-10-23)19-22-13-14-26-27(16-22)34-21-33-26/h4-11,13-14,16,20,29-30H,2-3,12,15,17-19,21H2,1H3