Vitas-M small molecule compound
(4E)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-5-[(phenylsulfanyl)methyl]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL324092
SMILES O=C1/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C(=NN1c1ccccc1)CSc1ccccc1
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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 C27H19N3O4S MW 481.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O4S/c31-27-24(17-22-14-15-26(34-22)19-8-7-11-21(16-19)30(32)33)25(18-35-23-12-5-2-6-13-23)28-29(27)20-9-3-1-4-10-20/h1-17H,18H2/b24-17+InChIKey
SXUAFKDIIBOREE-JJIBRWJFSA-NSynonyms
324070-90-8(4E)4((5(3nitrophenyl)furan2yl)methylidene)2phenyl5((phenylsulfanyl)methyl)24dihydro3Hpyrazol3one
(4E)4((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)2PHENYL5(PHENYLSULFANYLMETHYL)PYRAZOL3ONE
(E)4((5(3nitrophenyl)furan2yl)methylene)1phenyl3((phenylthio)methyl)1Hpyrazol5(4H)one
324070908
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))C(=N2)CSC5=CC=CC=C5
InChI=1SC27H19N3O4Sc312724(1722141526(3422)19871121(1619)30(32)33)25(183523125261323)2829(27)2093141020h117H18H2b2417+
MFCD01072380
O=C1C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))C(=NN1c1ccccc1)CSc1ccccc1
ZINC000011617212
ZINC11617212
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