1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(3-methyl-2-propan-2-yl-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(3-methyl-2-propan-2-yl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(2-isopropyl-3-methyl-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-3-(3-methyl-2-propan-2-ylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(3-methyl-2-propan-2-ylphenyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(2-isopropyl-3-methyl-phenyl)-1-piperonyl-thiourea Formula: C26H32N2O2S MolecularWeight: 436.60948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O2S/c1-18(2)25-19(3)8-7-11-22(25)27-26(31)28(15-20-9-5-4-6-10-20)16-21-12-13-23-24(14-21)30-17-29-23/h4-5,7-8,11-14,18,20H,6,9-10,15-17H2,1-3H3,(H,27,31)