Vitas-M small molecule compound
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(2-methoxy-5-nitrophenyl)methanesulfonamide
Catalog ID
STL100813
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCCCCC1)[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 C16H23N3O6S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O6S/c1-25-15-8-7-13(19(21)22)11-14(15)18(26(2,23)24)12-16(20)17-9-5-3-4-6-10-17/h7-8,11H,3-6,9-10,12H2,1-2H3InChIKey
ZMXZRUNVCHPVFU-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)N2CCCCCC2)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCCCCC1)(N+)(=O)(O)
InChI=1SC16H23N3O6Sc125158713(19(21)22)1114(15)18(26(223)24)1216(20)17953461017h7811H3691012H212H3
MFCD06623123
N(2(azepan1yl)2oxoethyl)N(2methoxy5nitrophenyl)methanesulfonamide
ZINC000002869370
ZINC02869370
ZINC2869370
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