874841-65-3
4-[2-(METHYLTHIO)PYRIMIDIN-4-YL]THIOPHENE-2-SULPHONYL CHLORIDE
Name4-[2-(METHYLTHIO)PYRIMIDIN-4-YL]THIOPHENE-2-SULPHONYL CHLORIDE
1Identification
【Name】
4-[2-(METHYLTHIO)PYRIMIDIN-4-YL]THIOPHENE-2-SULPHONYL CHLORIDE
【CAS】
【MDL】
MFCD07369007
【English Synonyms】
【Formula】
C9 H7 Cl N2 O2 S3
【MolWeight】
306.817
【Inchi】
InChI=1S/C9H7ClN2O2S3/c1-15-9-11-3-2-7(12-9)6-4-8(16-5-6)17(10,13)14/h2-5H,1H3
【InChIKey】
InChIKey=HAKBDXYKYHVSDC-UHFFFAOYSA-N
【SMILES】
CSc1nccc(n1)c2cc(sc2)S(=O)(=O)Cl
【MOL File】
4-[2-(METHYLTHIO)PYR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[2-(METHYLTHIO)PYRIMIDIN-4-YL]THIOPHENE-2-SULPHONYL CHLORIDE.cml