1-(1,3-benzodioxol-5-ylmethyl)-3-(3-butoxypropyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-butoxypropyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-butoxypropyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-butoxypropyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-butoxypropyl)thiourea Traditional Name: 1-(3-butoxypropyl)-3-piperonyl-thiourea Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3S/c1-2-3-8-19-9-4-7-17-16(22)18-11-13-5-6-14-15(10-13)21-12-20-14/h5-6,10H,2-4,7-9,11-12H2,1H3,(H2,17,18,22)