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

Systemtic Name: 3-cyclohexyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-cyclohexyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-cyclohexyl-1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-cyclohexyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-cyclohexyl-1-(2,4-dimethoxybenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C22H32N4O2S MolecularWeight: 416.58008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3CCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3CCCCC3)OC

InChI

InChI=1S/C22H32N4O2S/c1-27-20-10-9-18(21(15-20)28-2)16-26(13-6-12-25-14-11-23-17-25)22(29)24-19-7-4-3-5-8-19/h9-11,14-15,17,19H,3-8,12-13,16H2,1-2H3,(H,24,29)