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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-pentyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-pentyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-pentylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-pentylthiourea Traditional Name: 1-amyl-3-piperonyl-thiourea Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCNC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H20N2O2S/c1-2-3-4-7-15-14(19)16-9-11-5-6-12-13(8-11)18-10-17-12/h5-6,8H,2-4,7,9-10H2,1H3,(H2,15,16,19)