1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-octan-3-yl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-octan-3-yl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(1-ethylhexyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-3-octan-3-ylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-octan-3-ylthiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(1-ethylhexyl)-1-piperonyl-thiourea Formula: C24H36N2O2S MolecularWeight: 416.61984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC(=S)N(CC1CCC=CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCCC(CC)NC(=S)N(CC1CCC=CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C24H36N2O2S/c1-3-5-7-12-21(4-2)25-24(29)26(16-19-10-8-6-9-11-19)17-20-13-14-22-23(15-20)28-18-27-22/h6,8,13-15,19,21H,3-5,7,9-12,16-18H2,1-2H3,(H,25,29)