1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-isopropylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-cyclopentyl-3-p-cumenyl-1-piperonyl-thiourea Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

InChI

InChI=1S/C23H28N2O2S/c1-16(2)18-8-10-19(11-9-18)24-23(28)25(20-5-3-4-6-20)14-17-7-12-21-22(13-17)27-15-26-21/h7-13,16,20H,3-6,14-15H2,1-2H3,(H,24,28)