Vitas-M small molecule compound

N~2~-(2,5-dichlorophenyl)-N-(2-methyl-3-nitrophenyl)-N~2~-(methylsulfonyl)alaninamide

Catalog ID
STK257296
SMILES O=C(C(N(S(=O)(=O)C)c1cc(Cl)ccc1Cl)C)Nc1cccc(c1C)[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 C17H17Cl2N3O5S MW 446.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Cl2N3O5S/c1-10-14(5-4-6-15(10)22(24)25)20-17(23)11(2)21(28(3,26)27)16-9-12(18)7-8-13(16)19/h4-9,11H,1-3H3,(H,20,23)
InChIKey
APPMFPQHBQZUNY-UHFFFAOYSA-N
Synonyms

2(25dichloroNmethylsulfonylanilino)N(2methyl3nitrophenyl)propanamide
CC1=C(C=CC=C1(N+)(=O)(O))NC(=O)C(C)N(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C
InChI=1SC17H17Cl2N3O5Sc11014(54615(10)22(24)25)2017(23)11(2)21(28(326)27)16912(18)7813(16)19h4911H13H3(H2023)
MFCD08683061
N~2~(25dichlorophenyl)N(2methyl3nitrophenyl)N~2~(methylsulfonyl)alaninamide
N2(25DICHLOROPHENYL)N(2METHYL3NITROPHENYL)N2(METHYLSULFONYL)ALANINAMIDE
O=C(C(N(S(=O)(=O)C)c1cc(Cl)ccc1Cl)C)Nc1cccc(c1C)(N+)(=O)(O)
ZINC000009356134
ZINC000013855778

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Available files

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