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

Systemtic Name: 3-cycloheptyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-cycloheptyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-cycloheptyl-1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-cycloheptyl-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-cycloheptyl-1-(2,4-dimethoxybenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C23H34N4O2S MolecularWeight: 430.60666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3CCCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CCCN2C=CN=C2)C(=S)NC3CCCCCC3)OC

InChI

InChI=1S/C23H34N4O2S/c1-28-21-11-10-19(22(16-21)29-2)17-27(14-7-13-26-15-12-24-18-26)23(30)25-20-8-5-3-4-6-9-20/h10-12,15-16,18,20H,3-9,13-14,17H2,1-2H3,(H,25,30)