1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(2-ethylhexoxy)propyl]thiourea Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCCCNC(=S)NC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCC(CC)COCCCNC(=S)NC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C20H32N2O3S/c1-3-5-7-16(4-2)15-23-11-6-10-21-20(26)22-17-8-9-18-19(14-17)25-13-12-24-18/h8-9,14,16H,3-7,10-13,15H2,1-2H3,(H2,21,22,26)