5-bromanyl-N4-prop-2-ynyl-N2-[4-(trifluoromethylsulfanyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N4-prop-2-ynyl-N2-[4-(trifluoromethylsulfanyl)phenyl]pyrimidine-2,4-diamine Openeye Name: 5-bromo-N4-prop-2-ynyl-N2-[4-(trifluoromethylsulfanyl)phenyl]pyrimidine-2,4-diamine CAS Name: 5-bromo-N4-prop-2-ynyl-N2-[4-(trifluoromethylthio)phenyl]pyrimidine-2,4-diamine IUPAC Name: 5-bromo-4-N-prop-2-ynyl-2-N-[4-(trifluoromethylsulfanyl)phenyl]pyrimidine-2,4-diamine Traditional Name: [5-bromo-4-(propargylamino)pyrimidin-2-yl]-[4-(trifluoromethylthio)phenyl]amine Formula: C14H10BrF3N4S MolecularWeight: 403.22021

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=NC(=NC=C1Br)NC2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

C#CCNC1=NC(=NC=C1Br)NC2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C14H10BrF3N4S/c1-2-7-19-12-11(15)8-20-13(22-12)21-9-3-5-10(6-4-9)23-14(16,17)18/h1,3-6,8H,7H2,(H2,19,20,21,22)