98273-53-1
5-THIEN-2-YL-1,2,4-TRIAZINE-3(2H)-THIONE
Name5-THIEN-2-YL-1,2,4-TRIAZINE-3(2H)-THIONE
1Identification
【Name】
5-THIEN-2-YL-1,2,4-TRIAZINE-3(2H)-THIONE
【CAS】
【MDL】
MFCD06655603
【English Synonyms】
【Formula】
C7 H5 N3 S2
【MolWeight】
195.27
【Inchi】
InChI=1S/C7H5N3S2/c11-7-9-5(4-8-10-7)6-2-1-3-12-6/h1-4H,(H,9,10,11)
【InChIKey】
InChIKey=GMEFBTFURKGPRD-UHFFFAOYSA-N
【SMILES】
c1cc(sc1)c2cn[nH]c(=S)n2
【MOL File】
5-THIEN-2-YL-1,2,4-T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-THIEN-2-YL-1,2,4-TRIAZINE-3(2H)-THIONE.cml