Vitas-M small molecule compound
1-(5-chloro-2-methylphenyl)-4-[(4-methyl-3-nitrophenyl)sulfonyl]piperazine
Catalog ID
STL280709
SMILES Clc1ccc(c(c1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C)C
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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 C18H20ClN3O4S MW 409.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O4S/c1-13-3-5-15(19)11-17(13)20-7-9-21(10-8-20)27(25,26)16-6-4-14(2)18(12-16)22(23)24/h3-6,11-12H,7-10H2,1-2H3InChIKey
XIMUJPZVOZELGN-UHFFFAOYSA-NSynonyms
1(5chloro2methylphenyl)4((4methyl3nitrophenyl)sulfonyl)piperazine
1(5CHLORO2METHYLPHENYL)4(4METHYL3NITROPHENYL)SULFONYLPIPERAZINE
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)(N+)(=O)(O)
Clc1ccc(c(c1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C)C
InChI=1SC18H20ClN3O4Sc1133515(19)1117(13)207921(10820)27(2526)166414(2)18(1216)22(23)24h361112H710H212H3
MFCD04213783
ZINC000004983797
ZINC04983797
ZINC4983797
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