CAS Registry Number®
252964-68-4
CAS Name
2,4-Dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one
Molecular Formula
C23H29N5O2
Molecular Mass
407.51
Compound Properties
-
Melting Point (1)
189-191 °C
Source(s)
- (1) Chong, Curtis R.; ACS Chemical Biology, (2007), 2(4), 263-270, CAplus
Other Names and Identifiers
InChI
InChI=1S/C23H29N5O2/c1-4-18(2)28-23(29)27(17-24-28)21-7-5-19(6-8-21)25-13-15-26(16-14-25)20-9-11-22(30-3)12-10-20/h5-12,17-18H,4,13-16H2,1-3H3
InChIKey
InChIKey=IVIVGYTUQVJVPF-UHFFFAOYSA-N
SMILES
O=C1N(C=NN1C(CC)C)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(OC)C=C4
Canonical SMILES
O=C1N(C=NN1C(C)CC)C2=CC=C(C=C2)N3CCN(C4=CC=C(OC)C=C4)CC3
Other Names for this Substance
- 3H-1,2,4-Triazol-3-one, 2,4-dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-
- 2,4-Dihydro-4-[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-2-(1-methylpropyl)-3H-1,2,4-triazol-3-one
- 2-Butan-2-yl-4-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]-1,2,4-triazol-3-one
