573993-14-3
2-CYANO-N-(4-([(2,6-DIMETHYLPYRIMIDIN-4-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
Name2-CYANO-N-(4-([(2,6-DIMETHYLPYRIMIDIN-4-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
1Identification
【Name】
2-CYANO-N-(4-([(2,6-DIMETHYLPYRIMIDIN-4-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD01336180
【English Synonyms】
【Formula】
C15 H15 N5 O3 S
【MolWeight】
345.382
【Inchi】
InChI=1S/C15H15N5O3S/c1-10-9-14(18-11(2)17-10)20-24(22,23)13-5-3-12(4-6-13)19-15(21)7-8-16/h3-6,9H,7H2,1-2H3,(H,19,21)(H,17,18,20)
【InChIKey】
InChIKey=YPVZHNQNYHHUSY-UHFFFAOYSA-N
【SMILES】
Cc1cc(nc(n1)C)NS(=O)(=O)c2ccc(cc2)NC(=O)CC#N
【MOL File】
2-CYANO-N-(4-([(2,6-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CYANO-N-(4-([(2,6-DIMETHYLPYRIMIDIN-4-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE.cml