941879-47-6
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXAMIDE
Name4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXAMIDE
pro_formulaC12 H13 N3 O3 S2
1Identification
【Name】
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXAMIDE
【CAS】
【MDL】
MFCD09245627
【EnglishSynonyms】
【pro_formula】
C12 H13 N3 O3 S2
【pro_molWeight】
311.385
【Inchi】
InChI=1S/C12H13N3O3S2/c1-7-3-5-9(6-4-7)20(17,18)15-12-14-8(2)10(19-12)11(13)16/h3-6H,1-2H3,(H2,13,16)(H,14,15)
【InChIKey】
InChIKey=KSUOPBDVBLQAOA-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)Nc2nc(c(s2)C(=O)N)C
【MOL File】
4-METHYL-2-[[(4-METH….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-METHYL-2-[[(4-METHYLPHENYL)SULFONYL]AMINO]-5-THIAZOLECARBOXAMIDE.cml