1-(cyclohex-3-en-1-ylmethyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)thiourea

Systemtic Name: 1-(cyclohex-3-en-1-ylmethyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-(cyclohex-3-en-1-ylmethyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(1-cyclohex-3-enylmethyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-(cyclohex-3-en-1-ylmethyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-benzyl-1-(cyclohex-3-en-1-ylmethyl)-3-homoveratryl-thiourea Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)N(CC2CCC=CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)N(CC2CCC=CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C25H32N2O2S/c1-28-23-14-13-20(17-24(23)29-2)15-16-26-25(30)27(18-21-9-5-3-6-10-21)19-22-11-7-4-8-12-22/h3-7,9-10,13-14,17,22H,8,11-12,15-16,18-19H2,1-2H3,(H,26,30)