1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octan-3-yl-thiourea

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octan-3-yl-thiourea Openeye Name: 1-[(2,4-dimethoxyphenyl)methyl]-3-(1-ethylhexyl)-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-octan-3-ylthiourea IUPAC Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-octan-3-ylthiourea Traditional Name: 1-(2,4-dimethoxybenzyl)-3-(1-ethylhexyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C24H38N4O2S MolecularWeight: 446.64912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC(=S)N(CCCN1C=CN=C1)CC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCC(CC)NC(=S)N(CCCN1C=CN=C1)CC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C24H38N4O2S/c1-5-7-8-10-21(6-2)26-24(31)28(15-9-14-27-16-13-25-19-27)18-20-11-12-22(29-3)17-23(20)30-4/h11-13,16-17,19,21H,5-10,14-15,18H2,1-4H3,(H,26,31)