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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cycloheptyl-1-(cyclohex-3-en-1-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cycloheptyl-1-(cyclohex-3-en-1-ylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cycloheptyl-1-(1-cyclohex-3-enylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cycloheptyl-1-(cyclohex-3-en-1-ylmethyl)thiourea Traditional Name: 3-cycloheptyl-1-(cyclohex-3-en-1-ylmethyl)-1-piperonyl-thiourea Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=S)N(CC2CCC=CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)NC(=S)N(CC2CCC=CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H32N2O2S/c28-23(24-20-10-6-1-2-7-11-20)25(15-18-8-4-3-5-9-18)16-19-12-13-21-22(14-19)27-17-26-21/h3-4,12-14,18,20H,1-2,5-11,15-17H2,(H,24,28)