951921-79-2
4-METHYL-2-[METHYL[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXYLIC ACID
Name4-METHYL-2-[METHYL[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXYLIC ACID
1Identification
【Name】
4-METHYL-2-[METHYL[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXYLIC ACID
【CAS】
【MDL】
MFCD09905001
【English Synonyms】
【Formula】
C13 H14 N2 O4 S2
【MolWeight】
326.396
【Inchi】
InChI=1S/C13H14N2O4S2/c1-8-4-6-10(7-5-8)21(18,19)15(3)13-14-9(2)11(20-13)12(16)17/h4-7H,1-3H3,(H,16,17)
【InChIKey】
InChIKey=DYLAGOKLSFXNGZ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)N(C)c2nc(c(s2)C(=O)O)C
【MOL File】
4-METHYL-2-[METHYL[(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-METHYL-2-[METHYL[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXYLIC ACID.cml