51308-73-7
ETHYL (4-(1-METHYLETHYL)PHENYL)METHYL-3-PYRIDINYLCARBONIMIDODITHIOATE
NameETHYL (4-(1-METHYLETHYL)PHENYL)METHYL-3-PYRIDINYLCARBONIMIDODITHIOATE
1Identification
【Name】
ETHYL (4-(1-METHYLETHYL)PHENYL)METHYL-3-PYRIDINYLCARBONIMIDODITHIOATE
【CAS】
【MDL】
MFCD01937741
【English Synonyms】
【Formula】
C18 H22 N2 S2
【MolWeight】
330.518
【Inchi】
InChI=1S/C18H22N2S2/c1-4-21-18(20-17-6-5-11-19-12-17)22-13-15-7-9-16(10-8-15)14(2)3/h5-12,14H,4,13H2,1-3H3/b20-18+
【InChIKey】
InChIKey=IKNAQSSLUOYXFB-CZIZESTLSA-N
【SMILES】
CCS/C(=N\c1cccnc1)/SCc2ccc(cc2)C(C)C
【MOL File】
ETHYL (4-(1-METHYLET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL (4-(1-METHYLETHYL)PHENYL)METHYL-3-PYRIDINYLCARBONIMIDODITHIOATE.cml