Vitas-M small molecule compound
2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]-N-[4-(propan-2-yl)benzyl]aniline
Catalog ID
STK148722
SMILES [O-][N+](=O)c1ccc(cc1NCc1ccc(cc1)C(C)C)N1CCN(CC1)S(=O)(=O)c1ccccc1
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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 C26H30N4O4S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O4S/c1-20(2)22-10-8-21(9-11-22)19-27-25-18-23(12-13-26(25)30(31)32)28-14-16-29(17-15-28)35(33,34)24-6-4-3-5-7-24/h3-13,18,20,27H,14-17,19H2,1-2H3InChIKey
MOAKDGUXXBPKHE-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1NCc1ccc(cc1)C(C)C)N1CCN(CC1)S(=O)(=O)c1ccccc1
2NITRO5(4(PHENYLSULFONYL)PIPERAZIN1YL)N(4(PROPAN2YL)BENZYL)ANILINE
4(3(((4(METHYLETHYL)PHENYL)METHYL)AMINO)4NITROPHENYL)1(PHENYLSULFONYL)PIPERAZINE
5(4(BENZENESULFONYL)PIPERAZIN1YL)2NITRON((4PROPAN2YLPHENYL)METHYL)ANILINE
CC(C)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC26H30N4O4Sc120(2)2210821(91122)1927251823(121326(25)30(31)32)28141629(171528)35(3334)246435724h313182027H141719H212H3
MFCD02217989
ZINC000009601701
ZINC09601701
ZINC9601701
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