1-(1,3-benzodioxol-5-yl)-3-heptyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-heptyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-heptyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-heptylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-heptylthiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-heptyl-thiourea Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2S/c1-2-3-4-5-6-9-16-15(20)17-12-7-8-13-14(10-12)19-11-18-13/h7-8,10H,2-6,9,11H2,1H3,(H2,16,17,20)