1-(1,3-benzodioxol-5-ylmethyl)-1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-cyclopentyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-cyclopentyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-cyclopentyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(1S)-1-cyclohex-3-enyl]methyl]-3-cyclopentylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-cyclopentylthiourea Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-3-cyclopentyl-1-piperonyl-thiourea Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)N(CC2CCC=CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(C1)NC(=S)N(C[C@H]2CCC=CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H28N2O2S/c26-21(22-18-8-4-5-9-18)23(13-16-6-2-1-3-7-16)14-17-10-11-19-20(12-17)25-15-24-19/h1-2,10-12,16,18H,3-9,13-15H2,(H,22,26)/t16-/m1/s1