1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-ethylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-ethylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-ethylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-ethylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentyl-3-(4-ethylphenyl)thiourea Traditional Name: 1-cyclopentyl-3-(4-ethylphenyl)-1-piperonyl-thiourea Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

InChI

InChI=1S/C22H26N2O2S/c1-2-16-7-10-18(11-8-16)23-22(27)24(19-5-3-4-6-19)14-17-9-12-20-21(13-17)26-15-25-20/h7-13,19H,2-6,14-15H2,1H3,(H,23,27)