1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dichlorophenyl)-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dichlorophenyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dichlorophenyl)-1-(2-pyridylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dichlorophenyl)-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dichlorophenyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dichlorophenyl)-1-piperonyl-1-(2-pyridylmethyl)thiourea Formula: C21H17Cl2N3O2S MolecularWeight: 446.34958

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CC3=CC=CC=N3)C(=S)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CC3=CC=CC=N3)C(=S)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H17Cl2N3O2S/c22-15-5-6-18(17(23)10-15)25-21(29)26(12-16-3-1-2-8-24-16)11-14-4-7-19-20(9-14)28-13-27-19/h1-10H,11-13H2,(H,25,29)