29209-18-5
2H-1,2-BENZOTHIAZINE-4-CARBOXAMIDE, N-(2,5-DICHLOROPHENYL)-3,4-DIHYDRO-2-METHYL-3-OXO-, 1,1-DIOXIDE
Name2H-1,2-BENZOTHIAZINE-4-CARBOXAMIDE, N-(2,5-DICHLOROPHENYL)-3,4-DIHYDRO-2-METHYL-3-OXO-, 1,1-DIOXIDE
FormulaC16 H12 Cl2 N2 O4 S
1Identification
【Name】
2H-1,2-BENZOTHIAZINE-4-CARBOXAMIDE, N-(2,5-DICHLOROPHENYL)-3,4-DIHYDRO-2-METHYL-3-OXO-, 1,1-DIOXIDE
【CAS】
【MDL】
MFCD17019440
【English Synonyms】
【Formula】
C16 H12 Cl2 N2 O4 S
【MolWeight】
399.253
【Inchi】
InChI=1S/C16H12Cl2N2O4S/c1-20-16(22)14(10-4-2-3-5-13(10)25(20,23)24)15(21)19-12-8-9(17)6-7-11(12)18/h2-8,14H,1H3,(H,19,21)
【InChIKey】
InChIKey=BLNIIYXXVBQMGJ-UHFFFAOYSA-N
【SMILES】
CN1C(=O)C(c2ccccc2S1(=O)=O)C(=O)Nc3cc(ccc3Cl)Cl
【MOL File】
2H-1,2-BENZOTHIAZINE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2H-1,2-BENZOTHIAZINE-4-CARBOXAMIDE, N-(2,5-DICHLOROPHENYL)-3,4-DIHYDRO-2-METHYL-3-OXO-, 1,1-DIOXIDE.cml