195370-34-4
BENZOIC ACID, 4-CHLORO-2-((3-METHYLPHENYL)AMINO)-, 2-(AMINOTHIOXOMETHYL)HYDRAZIDE
NameBENZOIC ACID, 4-CHLORO-2-((3-METHYLPHENYL)AMINO)-, 2-(AMINOTHIOXOMETHYL)HYDRAZIDE
1Identification
【Name】
BENZOIC ACID, 4-CHLORO-2-((3-METHYLPHENYL)AMINO)-, 2-(AMINOTHIOXOMETHYL)HYDRAZIDE
【CAS】
【MDL】
MFCD01937496
【English Synonyms】
【Formula】
C15 H15 Cl N4 O S
【MolWeight】
334.829
【Inchi】
InChI=1S/C15H15ClN4OS/c1-9-3-2-4-11(7-9)18-13-8-10(16)5-6-12(13)14(21)19-20-15(17)22/h2-8,18H,1H3,(H,19,21)(H3,17,20,22)
【InChIKey】
InChIKey=ODMMQGKKARPFLE-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)Nc2cc(ccc2C(=O)NNC(=S)N)Cl
【MOL File】
BENZOIC ACID, 4-CHLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZOIC ACID, 4-CHLORO-2-((3-METHYLPHENYL)AMINO)-, 2-(AMINOTHIOXOMETHYL)HYDRAZIDE.cml