Vitas-M small molecule compound
5-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-N-ethyl-2-nitroaniline
Catalog ID
STK198632
SMILES CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
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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 C18H21BrN4O4S MW 469.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN4O4S/c1-2-20-17-13-15(5-8-18(17)23(24)25)21-9-11-22(12-10-21)28(26,27)16-6-3-14(19)4-7-16/h3-8,13,20H,2,9-12H2,1H3InChIKey
GNIPHIKMXSHZHU-UHFFFAOYSA-NSynonyms
5(4((4BROMOPHENYL)SULFONYL)PIPERAZIN1YL)NETHYL2NITROANILINE
5(4(4BROMOPHENYL)SULFONYLPIPERAZIN1YL)NETHYL2NITROANILINE
CCNC1=C(C=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)(N+)(=O)(O)
CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
InChI=1SC18H21BrN4O4Sc1220171315(5818(17)23(24)25)2191122(121021)28(2627)166314(19)4716h381320H2912H21H3
MFCD05826401
ZINC000009934604
ZINC09934604
ZINC9934604
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