1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)thiourea Traditional Name: 3-(3,4-dichlorophenyl)-1-(4-fluorophenyl)-1-piperonyl-thiourea Formula: C21H15Cl2FN2O2S MolecularWeight: 449.325403

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(C3=CC=C(C=C3)F)C(=S)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(C3=CC=C(C=C3)F)C(=S)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H15Cl2FN2O2S/c22-17-7-4-15(10-18(17)23)25-21(29)26(16-5-2-14(24)3-6-16)11-13-1-8-19-20(9-13)28-12-27-19/h1-10H,11-12H2,(H,25,29)