1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-3-mesityl-1-piperonyl-thiourea Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)N(CC2CCC=CC2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)N(CC2CCC=CC2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C25H30N2O2S/c1-17-11-18(2)24(19(3)12-17)26-25(30)27(14-20-7-5-4-6-8-20)15-21-9-10-22-23(13-21)29-16-28-22/h4-5,9-13,20H,6-8,14-16H2,1-3H3,(H,26,30)