1-(1,3-benzodioxol-5-ylmethyl)-3-(4-propylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-propylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-propylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-propylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-propylphenyl)thiourea Traditional Name: 1-piperonyl-3-(4-propylphenyl)thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O2S/c1-2-3-13-4-7-15(8-5-13)20-18(23)19-11-14-6-9-16-17(10-14)22-12-21-16/h4-10H,2-3,11-12H2,1H3,(H2,19,20,23)