Vitas-M small molecule compound
(3,4-dimethoxyphenyl)(4-{4-nitro-3-[(pyridin-3-ylmethyl)amino]phenyl}piperazin-1-yl)methanone
Catalog ID
STK323993
SMILES COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1cccnc1)[N+](=O)[O-]
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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 C25H27N5O5 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O5/c1-34-23-8-5-19(14-24(23)35-2)25(31)29-12-10-28(11-13-29)20-6-7-22(30(32)33)21(15-20)27-17-18-4-3-9-26-16-18/h3-9,14-16,27H,10-13,17H2,1-2H3InChIKey
KTXALYFGUWXLMF-UHFFFAOYSA-NSynonyms
(34dimethoxyphenyl)(4(4nitro3((pyridin3ylmethyl)amino)phenyl)piperazin1yl)methanone
(34dimethoxyphenyl)(4(4nitro3(pyridin3ylmethylamino)phenyl)piperazin1yl)methanone
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CN=CC=C4)OC
COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1cccnc1)(N+)(=O)(O)
InChI=1SC25H27N5O5c134238519(1424(23)352)25(31)29121028(111329)206722(30(32)33)21(1520)271718439261618h39141627H101317H212H3
MFCD06757957
ZINC000013632904
ZINC13632904
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