618077-90-0
1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOTHIOAMIDE
Name1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOTHIOAMIDE
pro_formulaC18 H15 N5 O2 S
1Identification
【Name】
1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOTHIOAMIDE
【CAS】
【MDL】
MFCD03509557
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H15 N5 O2 S
【pro_molWeight】
365.415
【Inchi】
InChI=1S/C18H15N5O2S/c1-10-4-5-14-21-17-13(18(24)22(14)8-10)7-12(16(20)26)15(19)23(17)9-11-3-2-6-25-11/h2-8,19H,9H2,1H3,(H2,20,26)
【InChIKey】
InChIKey=KMAFBTUXTREYLR-UHFFFAOYSA-N
【SMILES】
Cc1ccc2nc3c(cc(c(=N)n3Cc4ccco4)C(=S)N)c(=O)n2c1
【MOL File】
1-(2-FURYLMETHYL)-2-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:7
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(2-FURYLMETHYL)-2-IMINO-8-METHYL-5-OXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOTHIOAMIDE.cml