1-(cyclohex-3-en-1-ylmethyl)-3-(3,5-dimethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(3,5-dimethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(3,5-dimethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 1-(1-cyclohex-3-enylmethyl)-3-(3,5-dimethoxyphenyl)-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(3,5-dimethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(3,5-dimethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3)OC

InChI

InChI=1S/C22H30N4O2S/c1-27-20-13-19(14-21(15-20)28-2)24-22(29)26(16-18-7-4-3-5-8-18)11-6-10-25-12-9-23-17-25/h3-4,9,12-15,17-18H,5-8,10-11,16H2,1-2H3,(H,24,29)