1-(3-bromanylpyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(3-bromanylpyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(3-bromo-2-pyridyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(3-bromo-2-pyridinyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(3-bromopyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(3-bromo-2-pyridyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(=S)NC2=C(C=CC=N2)Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNC(=S)NC2=C(C=CC=N2)Br

InChI

InChI=1S/C16H18BrN3O2S/c1-21-12-5-6-14(22-2)11(10-12)7-9-19-16(23)20-15-13(17)4-3-8-18-15/h3-6,8,10H,7,9H2,1-2H3,(H2,18,19,20,23)