77651-49-1
5,6,7,8-TETRAHYDRO-1H-[1]BENZOTHIENO[2,3-C][1,2,6]THIADIAZIN-4(3H)-ONE-2-OXIDE
Name5,6,7,8-TETRAHYDRO-1H-[1]BENZOTHIENO[2,3-C][1,2,6]THIADIAZIN-4(3H)-ONE-2-OXIDE
1Identification
【Name】
5,6,7,8-TETRAHYDRO-1H-[1]BENZOTHIENO[2,3-C][1,2,6]THIADIAZIN-4(3H)-ONE-2-OXIDE
【CAS】
【MDL】
MFCD11044388
【English Synonyms】
【Formula】
C9 H10 N2 O2 S2
【MolWeight】
242.322
【Inchi】
InChI=1S/C9H10N2O2S2/c12-8-7-5-3-1-2-4-6(5)14-9(7)11-15(13)10-8/h11H,1-4H2,(H,10,12)
【InChIKey】
InChIKey=LZAOFKXFECPHEJ-UHFFFAOYSA-N
【SMILES】
C1CCc2c(c3c(s2)NS(=O)NC3=O)C1
【MOL File】
5,6,7,8-TETRAHYDRO-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5,6,7,8-TETRAHYDRO-1H-[1]BENZOTHIENO[2,3-C][1,2,6]THIADIAZIN-4(3H)-ONE-2-OXIDE.cml