Vitas-M small molecule compound

(4Z)-5-methyl-2-(4-nitrophenyl)-4-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK741689
SMILES CC1=NN(C(=O)/C/1=C\NCC1CCCO1)c1ccc(cc1)[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 C16H18N4O4 MW 330.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4/c1-11-15(10-17-9-14-3-2-8-24-14)16(21)19(18-11)12-4-6-13(7-5-12)20(22)23/h4-7,10,14,17H,2-3,8-9H2,1H3/b15-10-
InChIKey
GRZJLYNWHJBCAU-GDNBJRDFSA-N
Synonyms

(4Z)5methyl2(4nitrophenyl)4(((tetrahydrofuran2ylmethyl)amino)methylidene)24dihydro3Hpyrazol3one
(4Z)5METHYL2(4NITROPHENYL)4((OXOLAN2YLMETHYLAMINO)METHYLIDENE)PYRAZOL3ONE
(E)3methyl1(4nitrophenyl)4((((tetrahydrofuran2yl)methyl)amino)methylene)1Hpyrazol5(4H)one
3METHYL1(4NITROPHENYL)4(((OXOLAN2YLMETHYL)AMINO)METHYLENE)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CNCC2CCCO2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H18N4O4c11115(10179143282414)16(21)19(1811)124613(7512)20(22)23h47101417H2389H21H3b1510
MFCD02044266
ZINC000013554977
ZINC000013554979

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Available files

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