97189-36-1
ALPHA-((DIMETHYLAMINO)METHYLENE)-6-METHYL-N-PHENYL-4-PYRIMIDINEETHANETHIOAMIDE
NameALPHA-((DIMETHYLAMINO)METHYLENE)-6-METHYL-N-PHENYL-4-PYRIMIDINEETHANETHIOAMIDE
1Identification
【Name】
ALPHA-((DIMETHYLAMINO)METHYLENE)-6-METHYL-N-PHENYL-4-PYRIMIDINEETHANETHIOAMIDE
【CAS】
【MDL】
MFCD01689378
【English Synonyms】
【Formula】
C16 H18 N4 S
【MolWeight】
298.412
【Inchi】
InChI=1S/C16H18N4S/c1-12-9-15(18-11-17-12)14(10-20(2)3)16(21)19-13-7-5-4-6-8-13/h4-11H,1-3H3,(H,19,21)/b14-10+
【InChIKey】
InChIKey=RUEKPHNZYSPNMY-GXDHUFHOSA-N
【SMILES】
Cc1cc(ncn1)/C(=C\N(C)C)/C(=S)Nc2ccccc2
【MOL File】
ALPHA-((DIMETHYLAMIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA-((DIMETHYLAMINO)METHYLENE)-6-METHYL-N-PHENYL-4-PYRIMIDINEETHANETHIOAMIDE.cml