1-(1,3-benzodioxol-5-yl)-3-(5-bromanylpyridin-2-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromanylpyridin-2-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-pyridyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-pyridinyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromopyridin-2-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-pyridyl)thiourea Formula: C13H10BrN3O2S MolecularWeight: 352.2064

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NC=C(C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C13H10BrN3O2S/c14-8-1-4-12(15-6-8)17-13(20)16-9-2-3-10-11(5-9)19-7-18-10/h1-6H,7H2,(H2,15,16,17,20)