Vitas-M small molecule compound

N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-[(4-methylphenyl)sulfonyl]-N~2~-(3-nitrophenyl)glycinamide

Catalog ID
STL119541
SMILES O=C(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])Nc1c(C)n(n(c1=O)c1ccccc1)C

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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 C26H25N5O6S MW 535.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O6S/c1-18-12-14-23(15-13-18)38(36,37)29(21-10-7-11-22(16-21)31(34)35)17-24(32)27-25-19(2)28(3)30(26(25)33)20-8-5-4-6-9-20/h4-16H,17H2,1-3H3,(H,27,32)
InChIKey
BPNGWGBHXOZCQW-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC26H25N5O6Sc118121423(151318)38(3637)29(211071122(1621)31(34)35)1724(32)272519(2)28(3)30(26(25)33)208546920h416H17H213H3(H2732)
MFCD05986626
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)N~2~((4methylphenyl)sulfonyl)N~2~(3nitrophenyl)glycinamide
N(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)N2((4METHYLPHENYL)SULFONYL)N2(3NITROPHENYL)GLYCINAMIDE
N(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)2(N(4METHYLPHENYL)SULFONYL3NITROANILINO)ACETAMIDE
O=C(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)(N+)(=O)(O))Nc1c(C)n(n(c1=O)c1ccccc1)C
ZINC000059595950
ZINC59595950

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Available files

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