1-(1,3-benzodioxol-5-ylmethyl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1,3-benzodioxol-5-ylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-prop-2-enylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-piperonyl-thiourea Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O2S/c1-2-5-13-12(17)14-7-9-3-4-10-11(6-9)16-8-15-10/h2-4,6H,1,5,7-8H2,(H2,13,14,17)