Vitas-M small molecule compound

N-cyclohexyl-2-{[N-(2-methoxy-5-nitrophenyl)-N-(methylsulfonyl)glycyl]amino}benzamide

Catalog ID
STK357654
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)NC1CCCCC1)[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 C23H28N4O7S MW 504.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O7S/c1-34-21-13-12-17(27(30)31)14-20(21)26(35(2,32)33)15-22(28)25-19-11-7-6-10-18(19)23(29)24-16-8-4-3-5-9-16/h6-7,10-14,16H,3-5,8-9,15H2,1-2H3,(H,24,29)(H,25,28)
InChIKey
BFSWIJNJOBAHSH-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)NC2=CC=CC=C2C(=O)NC3CCCCC3)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)NC1CCCCC1)(N+)(=O)(O)
InChI=1SC23H28N4O7Sc13421131217(27(30)31)1420(21)26(35(232)33)1522(28)251911761018(19)23(29)24168435916h67101416H358915H212H3(H2429)(H2528)
MFCD06623372
NCYCLOHEXYL2((2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETYL)AMINO)BENZAMIDE
NCYCLOHEXYL2((N(2METHOXY5NITROPHENYL)N(METHYLSULFONYL)GLYCYL)AMINO)BENZAMIDE
ZINC000016226971
ZINC16226971

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Available files

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