1-(1,3-benzodioxol-5-ylmethyl)-3-(1-methoxybutan-2-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-methoxybutan-2-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[1-(methoxymethyl)propyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-methoxybutan-2-yl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(1-methoxybutan-2-yl)thiourea Traditional Name: 1-[1-(methoxymethyl)propyl]-3-piperonyl-thiourea Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(COC)NC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H20N2O3S/c1-3-11(8-17-2)16-14(20)15-7-10-4-5-12-13(6-10)19-9-18-12/h4-6,11H,3,7-9H2,1-2H3,(H2,15,16,20)