581782-17-4
2-CYANO-N-(4-([(4-METHYLPYRIMIDIN-2-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
Name2-CYANO-N-(4-([(4-METHYLPYRIMIDIN-2-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
1Identification
【Name】
2-CYANO-N-(4-([(4-METHYLPYRIMIDIN-2-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD03374940
【English Synonyms】
【Formula】
C14 H13 N5 O3 S
【MolWeight】
331.355
【Inchi】
InChI=1S/C14H13N5O3S/c1-10-7-9-16-14(17-10)19-23(21,22)12-4-2-11(3-5-12)18-13(20)6-8-15/h2-5,7,9H,6H2,1H3,(H,18,20)(H,16,17,19)
【InChIKey】
InChIKey=SVNNOIOVSCNOFU-UHFFFAOYSA-N
【SMILES】
Cc1ccnc(n1)NS(=O)(=O)c2ccc(cc2)NC(=O)CC#N
【MOL File】
2-CYANO-N-(4-([(4-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CYANO-N-(4-([(4-METHYLPYRIMIDIN-2-YL)AMINO]SULFONYL)PHENYL)ACETAMIDE.cml