Vitas-M small molecule compound
N-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-N-(2-methoxy-5-nitrophenyl)methanesulfonamide
Catalog ID
STK357618
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCC(CC1)Cc1ccccc1)[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 C22H27N3O6S MW 461.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O6S/c1-31-21-9-8-19(25(27)28)15-20(21)24(32(2,29)30)16-22(26)23-12-10-18(11-13-23)14-17-6-4-3-5-7-17/h3-9,15,18H,10-14,16H2,1-2H3InChIKey
SVYXMJUYYKROFW-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)N2CCC(CC2)CC3=CC=CC=C3)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCC(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC22H27N3O6Sc131219819(25(27)28)1520(21)24(32(229)30)1622(26)23121018(111323)14176435717h391518H101416H212H3
MFCD06623379
N(2(4BENZYLPIPERIDIN1YL)2OXOETHYL)N(2METHOXY5NITROPHENYL)METHANESULFONAMIDE
ZINC000016226947
ZINC16226947
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