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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1,3-benzodioxol-5-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-prop-2-enylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(1,3-benzodioxol-5-yl)thiourea Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

C=CCNC(=S)NC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H12N2O2S/c1-2-5-12-11(16)13-8-3-4-9-10(6-8)15-7-14-9/h2-4,6H,1,5,7H2,(H2,12,13,16)