Vitas-M small molecule compound
5-[4-(ethylsulfonyl)piperazin-1-yl]-2-nitro-N-(1-phenylethyl)aniline
Catalog ID
STK148815
SMILES CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC(c1ccccc1)C)[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 C20H26N4O4S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O4S/c1-3-29(27,28)23-13-11-22(12-14-23)18-9-10-20(24(25)26)19(15-18)21-16(2)17-7-5-4-6-8-17/h4-10,15-16,21H,3,11-14H2,1-2H3InChIKey
UUKRSZSKURUMHQ-UHFFFAOYSA-NSynonyms
(5(4ESYLPIPERAZINO)2NITROPHENYL)(1PHENYLETHYL)AMINE
5(4(ETHYLSULFONYL)1PIPERAZINYL)2NITRON(1PHENYLETHYL)ANILINE
5(4(ETHYLSULFONYL)PIPERAZIN1YL)2NITRON(1PHENYLETHYL)ANILINE
5(4ETHYLSULFONYL1PIPERAZINYL)2NITRON(1PHENYLETHYL)ANILINE
5(4ETHYLSULFONYLPIPERAZIN1YL)2NITRON(1PHENYLETHYL)ANILINE
CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC(c1ccccc1)C)(N+)(=O)(O)
CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NC(C)C3=CC=CC=C3
InChI=1SC20H26N4O4Sc1329(2728)23131122(121423)1891020(24(25)26)19(1518)2116(2)177546817h410151621H31114H212H3
MFCD02629890
ZINC000004143363
ZINC000004143367
ZINC04143363
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