1-(2-Pyridyl)-3,3-bis(methylthio)propenone

Catalog Number	ACM78570340
CAS	78570-34-0
Synonyms	3,3-Bis(methylthio)-1-(pyridin-2-yl)prop-2-en-1-one
IUPAC Name	3,3-bis(methylsulfanyl)-1-pyridin-2-ylprop-2-en-1-one
Molecular Weight	225.33
Molecular Formula	C10H11NOS2
InChI	InChI=1S/C10H11NOS2/c1-13-10(14-2)7-9(12)8-5-3-4-6-11-8/h3-7H,1-2H3
InChI Key	AATMJUDJDOFFHX-UHFFFAOYSA-N
Complexity	222
Exact Mass	225.02820632 g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	CSC(=CC(=O)C1=CC=CC=N1)SC
Monoisotopic Mass	225.02820632 g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	80.6Ų