Vitas-M small molecule compound
N-[4-(cyanomethyl)phenyl]-4-methyl-3-nitrobenzenesulfonamide
Catalog ID
STL136999
SMILES N#CCc1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])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 C15H13N3O4S MW 331.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O4S/c1-11-2-7-14(10-15(11)18(19)20)23(21,22)17-13-5-3-12(4-6-13)8-9-16/h2-7,10,17H,8H2,1H3InChIKey
IMTSEYLXPNGVML-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CC#N)(N+)(=O)(O)
InChI=1SC15H13N3O4Sc1112714(1015(11)18(19)20)23(2122)17135312(4613)8916h271017H8H21H3
MFCD04208515
N#CCc1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
N(4(cyanomethyl)phenyl)4methyl3nitrobenzenesulfonamide
ZINC000004702020
ZINC04702020
ZINC4702020
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