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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-decyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-decyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-decylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-decylthiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-decyl-thiourea Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O2S/c1-2-3-4-5-6-7-8-9-12-19-18(23)20-15-10-11-16-17(13-15)22-14-21-16/h10-11,13H,2-9,12,14H2,1H3,(H2,19,20,23)