1-(1,3-benzodioxol-5-ylmethyl)-3-(3-phenylpropyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCCCC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCCCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c23-18(19-10-4-7-14-5-2-1-3-6-14)20-12-15-8-9-16-17(11-15)22-13-21-16/h1-3,5-6,8-9,11H,4,7,10,12-13H2,(H2,19,20,23)