1-(3-bromanylpyridin-2-yl)-3-[2-(3-ethynylphenyl)ethyl]thiourea

Systemtic Name: 1-(3-bromanylpyridin-2-yl)-3-[2-(3-ethynylphenyl)ethyl]thiourea Openeye Name: 1-(3-bromo-2-pyridyl)-3-[2-(3-ethynylphenyl)ethyl]thiourea CAS Name: 1-(3-bromo-2-pyridinyl)-3-[2-(3-ethynylphenyl)ethyl]thiourea IUPAC Name: 1-(3-bromopyridin-2-yl)-3-[2-(3-ethynylphenyl)ethyl]thiourea Traditional Name: 1-(3-bromo-2-pyridyl)-3-[2-(3-ethynylphenyl)ethyl]thiourea Formula: C16H14BrN3S MolecularWeight: 360.27146

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)CCNC(=S)NC2=C(C=CC=N2)Br

Isomeric SMILES

C#CC1=CC(=CC=C1)CCNC(=S)NC2=C(C=CC=N2)Br

InChI

InChI=1S/C16H14BrN3S/c1-2-12-5-3-6-13(11-12)8-10-19-16(21)20-15-14(17)7-4-9-18-15/h1,3-7,9,11H,8,10H2,(H2,18,19,20,21)