975-21-3
1-((4,9-DIMETHOXY-5H-FURO(3,2-G)(1)BENZOPYRAN-5-ON-7-YL)METHYLENE)THIOSEMICARBAZONE
Name1-((4,9-DIMETHOXY-5H-FURO(3,2-G)(1)BENZOPYRAN-5-ON-7-YL)METHYLENE)THIOSEMICARBAZONE
1Identification
【Name】
1-((4,9-DIMETHOXY-5H-FURO(3,2-G)(1)BENZOPYRAN-5-ON-7-YL)METHYLENE)THIOSEMICARBAZONE
【CAS】
【MDL】
MFCD01938003
【English Synonyms】
【Formula】
C15 H13 N3 O5 S
【MolWeight】
347.35
【Inchi】
InChI=1S/C15H13N3O5S/c1-20-11-8-3-4-22-12(8)14(21-2)13-10(11)9(19)5-7(23-13)6-17-18-15(16)24/h3-6H,1-2H3,(H3,16,18,24)/b17-6+
【InChIKey】
InChIKey=QSLILLASGLAGLN-UBKPWBPPSA-N
【SMILES】
COc1c2ccoc2c(c3c1c(=O)cc(o3)/C=N/NC(=S)N)OC
【MOL File】
1-((4,9-DIMETHOXY-5H….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-((4,9-DIMETHOXY-5H-FURO(3,2-G)(1)BENZOPYRAN-5-ON-7-YL)METHYLENE)THIOSEMICARBAZONE.cml