Vitas-M small molecule compound
5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-2-nitro-N-(pyridin-3-ylmethyl)aniline
Catalog ID
STK148929
SMILES Cc1ccc(cc1)S(=O)(=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 C23H25N5O4S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O4S/c1-18-4-7-21(8-5-18)33(31,32)27-13-11-26(12-14-27)20-6-9-23(28(29)30)22(15-20)25-17-19-3-2-10-24-16-19/h2-10,15-16,25H,11-14,17H2,1H3InChIKey
HDTYKSOMKNWQDO-UHFFFAOYSA-NSynonyms
5(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITRON(PYRIDIN3YLMETHYL)ANILINE
5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITRON(PYRIDIN3YLMETHYL)ANILINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CN=CC=C4
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NCc1cccnc1)(N+)(=O)(O)
InChI=1SC23H25N5O4Sc1184721(8518)33(3132)27131126(121427)206923(28(29)30)22(1520)2517193210241619h210151625H111417H21H3
MFCD02631997
ZINC000009601761
ZINC09601761
ZINC9601761
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