6337-94-6
(PHENYLAMINO)(4-((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)METHANE-1-THIONE
Name(PHENYLAMINO)(4-((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)METHANE-1-THIONE
1Identification
【Name】
(PHENYLAMINO)(4-((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)METHANE-1-THIONE
【CAS】
【MDL】
MFCD00170216
【English Synonyms】
【Formula】
C18 H20 N4 S2
【MolWeight】
356.516
【Inchi】
InChI=1S/C18H20N4S2/c23-17(19-15-7-3-1-4-8-15)21-11-13-22(14-12-21)18(24)20-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,23)(H,20,24)
【InChIKey】
InChIKey=OZJSIZWZVYVUQC-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)NC(=S)N2CCN(CC2)C(=S)Nc3ccccc3
【MOL File】
(PHENYLAMINO)(4-((PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(PHENYLAMINO)(4-((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)METHANE-1-THIONE.cml