[4-(cyanomethylsulfanyl)-2-methyl-6-oxo-1H-pyrimidin-5-yl]-triphenyl-phosphanium chloride
Molecular Formula:
C
25
H
21
ClN
3
OPS
InChI:
InChI=1/C25H20N3OPS.ClH/c1-19-27-24(29)23(25(28-19)31-18-17-26)30(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22;/h2-16H,18H2,1H3;1H/fC25H21N3OPS.Cl/h27H;1h/q+1;-1
InChIKey:
InChIKey=KACWJHQQZJYZQZ-XTFPXIMUCC
SMILES:
CC1=NC(=C(C(=O)N1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)SCC#N.[Cl-]
Names:
[4-(cyanomethylsulfanyl)-2-methyl-6-oxo-1H-pyrimidin-5-yl]-triphenyl-phosphanium chloride
Registries:
PubChem CID 2795271
PubChem ID 3250821