Vitas-M small molecule compound
(4Z)-4-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK168103
SMILES CC1=NN(C(=O)/C/1=C\c1cc(n(c1C)c1cccc(c1)[N+](=O)[O-])C)c1ccccc1
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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 C23H20N4O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3/c1-15-12-18(17(3)25(15)20-10-7-11-21(14-20)27(29)30)13-22-16(2)24-26(23(22)28)19-8-5-4-6-9-19/h4-14H,1-3H3/b22-13-InChIKey
GMSNHQCCOINLRK-XKZIYDEJSA-NSynonyms
330632-80-9(4Z)4((25DIMETHYL1(3NITROPHENYL)1HPYRROL3YL)METHYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
(4Z)4((25DIMETHYL1(3NITROPHENYL)PYRROL3YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(E)4((25dimethyl1(3nitrophenyl)1Hpyrrol3yl)methylene)3methyl1phenyl1Hpyrazol5(4H)one
330632809
CC1=CC(=C(N1C2=CC(=CC=C2)(N+)(=O)(O))C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C
CC1=NN(C(=O)C1=Cc1cc(n(c1C)c1cccc(c1)(N+)(=O)(O))C)c1ccccc1
InChI=1SC23H20N4O3c1151218(17(3)25(15)201071121(1420)27(29)30)132216(2)2426(23(22)28)198546919h414H13H3b2213
MFCD01541321
ZINC000000843408
ZINC00843408
ZINC843408
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