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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4-dichlorophenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4-dichlorophenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-3-(2,4-dichlorophenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2,4-dichlorophenyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(2,4-dichlorophenyl)-1-piperonyl-thiourea Formula: C22H22Cl2N2O2S MolecularWeight: 449.39328

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CC(CC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H22Cl2N2O2S/c23-17-7-8-19(18(24)11-17)25-22(29)26(12-15-4-2-1-3-5-15)13-16-6-9-20-21(10-16)28-14-27-20/h1-2,6-11,15H,3-5,12-14H2,(H,25,29)