52420-78-7
1,1'-(PROPANE-1,3-DIYL)BIS(3-PHENYLTHIOUREA)
Name1,1'-(PROPANE-1,3-DIYL)BIS(3-PHENYLTHIOUREA)
1Identification
【Name】
1,1'-(PROPANE-1,3-DIYL)BIS(3-PHENYLTHIOUREA)
【CAS】
【MDL】
MFCD01105846
【English Synonyms】
【Formula】
C17 H20 N4 S2
【MolWeight】
344.505
【Inchi】
InChI=1S/C17H20N4S2/c22-16(20-14-8-3-1-4-9-14)18-12-7-13-19-17(23)21-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H2,18,20,22)(H2,19,21,23)
【InChIKey】
InChIKey=QKXXHJDAEXMAFC-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)NC(=S)NCCCNC(=S)Nc2ccccc2
【MOL File】
1,1'-(PROPANE-1,3-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,1'-(PROPANE-1,3-DIYL)BIS(3-PHENYLTHIOUREA).cml