1-(1,3-benzodioxol-5-ylmethyl)-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-piperonyl-3-[2-propoxy-5-(trifluoromethyl)phenyl]thiourea Formula: C19H19F3N2O3S MolecularWeight: 412.42597

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H19F3N2O3S/c1-2-7-25-15-6-4-13(19(20,21)22)9-14(15)24-18(28)23-10-12-3-5-16-17(8-12)27-11-26-16/h3-6,8-9H,2,7,10-11H2,1H3,(H2,23,24,28)