Vitas-M small molecule compound
7-(4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Catalog ID
STK712871
SMILES [O-][N+](=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)c1cc(=O)n2c(n1)sc(n2)C(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H29N7O3S MW 519.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N7O3S/c1-18(2)25-29-32-24(34)17-23(28-26(32)37-25)31-14-12-30(13-15-31)20-8-9-22(33(35)36)21(16-20)27-11-10-19-6-4-3-5-7-19/h3-9,16-18,27H,10-15H2,1-2H3InChIKey
PFNQLMNRRLZRBJ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)c1cc(=O)n2c(n1)sc(n2)C(C)C
7(4(4nitro3((2phenylethyl)amino)phenyl)piperazin1yl)2(propan2yl)5H(134)thiadiazolo(32a)pyrimidin5one
7(4(4nitro3(2phenylethylamino)phenyl)piperazin1yl)2propan2yl(134)thiadiazolo(32a)pyrimidin5one
7(4(4NITRO3(PHENETHYLAMINO)PHENYL)PIPERAZIN1YL)2PROPAN2YL(134)THIADIAZOLO(32A)PYRIMIDIN5ONE
CC(C)C1=NN2C(=O)C=C(N=C2S1)N3CCN(CC3)C4=CC(=C(C=C4)(N+)(=O)(O))NCCC5=CC=CC=C5
InChI=1SC26H29N7O3Sc118(2)25293224(34)1723(2826(32)3725)31141230(131531)208922(33(35)36)21(1620)271110196435719h39161827H1015H212H3
MFCD03941641
ZINC000005945209
ZINC5945209
Check stock
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