Vitas-M small molecule compound

N-[2-(cyclohex-1-en-1-yl)ethyl]-N~2~-(methylsulfonyl)-N~2~-(3-nitrophenyl)glycinamide

Catalog ID
STL061260
SMILES O=C(CN(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-])NCCC1=CCCCC1

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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 C17H23N3O5S MW 381.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O5S/c1-26(24,25)19(15-8-5-9-16(12-15)20(22)23)13-17(21)18-11-10-14-6-3-2-4-7-14/h5-6,8-9,12H,2-4,7,10-11,13H2,1H3,(H,18,21)
InChIKey
GIPQPEJXEAJDEM-UHFFFAOYSA-N
Synonyms

CS(=O)(=O)N(CC(=O)NCCC1=CCCCC1)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC17H23N3O5Sc126(2425)19(1585916(1215)20(22)23)1317(21)181110146324714h568912H247101113H21H3(H1821)
MFCD03252855
N(2(cyclohex1en1yl)ethyl)N~2~(methylsulfonyl)N~2~(3nitrophenyl)glycinamide
N(2(CYCLOHEX1EN1YL)ETHYL)N2(METHYLSULFONYL)N2(3NITROPHENYL)GLYCINAMIDE
N(2(CYCLOHEXEN1YL)ETHYL)2(NMETHYLSULFONYL3NITROANILINO)ACETAMIDE
N1(2(1CYCLOHEXEN1YL)ETHYL)N2(METHYLSULFONYL)N2(3NITROPHENYL)GLYCINAMIDE
O=C(CN(S(=O)(=O)C)c1cccc(c1)(N+)(=O)(O))NCCC1=CCCCC1
ZINC000002812772
ZINC02812772
ZINC2812772

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Available files

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