Vitas-M small molecule compound
(4E)-2-(3-chlorophenyl)-4-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK761360
SMILES Clc1cccc(c1)N1N=C(/C(=C\c2ccc(o2)c2cc(C)c(cc2[N+](=O)[O-])C)/C1=O)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 C23H18ClN3O4 MW 435.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O4/c1-13-9-20(21(27(29)30)10-14(13)2)22-8-7-18(31-22)12-19-15(3)25-26(23(19)28)17-6-4-5-16(24)11-17/h4-12H,1-3H3/b19-12+InChIKey
JLVJPTTYWLYEMW-XDHOZWIPSA-NSynonyms
(4E)2(3chlorophenyl)4((5(45dimethyl2nitrophenyl)furan2yl)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(3CHLOROPHENYL)4((5(45DIMETHYL2NITROPHENYL)FURAN2YL)METHYLIDENE)5METHYLPYRAZOL3ONE
4((5(45DIMETHYL2NITROPHENYL)(2FURYL))METHYLENE)1(3CHLOROPHENYL)3METHYL12DIAZOLIN5ONE
CC1=C(C=C(C(=C1)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC(=CC=C4)Cl)C)(N+)(=O)(O))C
Clc1cccc(c1)N1N=C(C(=Cc2ccc(o2)c2cc(C)c(cc2(N+)(=O)(O))C)C1=O)C
InChI=1SC23H18ClN3O4c113920(21(27(29)30)1014(13)2)228718(3122)121915(3)2526(23(19)28)1764516(24)1117h412H13H3b1912+
MFCD01909404
ZINC000008856164
ZINC08856164
ZINC8856164
Check stock
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