1-(3-bromanylpyrazin-2-yl)-3-[2-[2,3,4-tris(fluoranyl)phenyl]ethyl]thiourea

Systemtic Name: 1-(3-bromanylpyrazin-2-yl)-3-[2-[2,3,4-tris(fluoranyl)phenyl]ethyl]thiourea Openeye Name: 1-(3-bromopyrazin-2-yl)-3-[2-(2,3,4-trifluorophenyl)ethyl]thiourea CAS Name: 1-(3-bromo-2-pyrazinyl)-3-[2-(2,3,4-trifluorophenyl)ethyl]thiourea IUPAC Name: 1-(3-bromopyrazin-2-yl)-3-[2-(2,3,4-trifluorophenyl)ethyl]thiourea Traditional Name: 1-(3-bromopyrazin-2-yl)-3-[2-(2,3,4-trifluorophenyl)ethyl]thiourea Formula: C13H10BrF3N4S MolecularWeight: 391.20951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CCNC(=S)NC2=NC=CN=C2Br)F)F)F

Isomeric SMILES

C1=CC(=C(C(=C1CCNC(=S)NC2=NC=CN=C2Br)F)F)F

InChI

InChI=1S/C13H10BrF3N4S/c14-11-12(19-6-5-18-11)21-13(22)20-4-3-7-1-2-8(15)10(17)9(7)16/h1-2,5-6H,3-4H2,(H2,19,20,21,22)