Vitas-M small molecule compound
(3Z)-3-(4-nitrobenzylidene)-1-{4-[(4-nitrophenyl)sulfanyl]phenyl}-5-phenyl-1,3-dihydro-2H-pyrrol-2-one
Catalog ID
STK199217
SMILES O=C1/C(=C\c2ccc(cc2)[N+](=O)[O-])/C=C(N1c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-])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 C29H19N3O5S MW 521.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19N3O5S/c33-29-22(18-20-6-8-24(9-7-20)31(34)35)19-28(21-4-2-1-3-5-21)30(29)23-10-14-26(15-11-23)38-27-16-12-25(13-17-27)32(36)37/h1-19H/b22-18-InChIKey
OXKIHODDYVJBMF-PYCFMQQDSA-NSynonyms
(3Z)3((4NITROPHENYL)METHYLIDENE)1(4(4NITROPHENYL)SULFANYLPHENYL)5PHENYLPYRROL2ONE
(3Z)3(4NITROBENZYLIDENE)1(4((4NITROPHENYL)SULFANYL)PHENYL)5PHENYL13DIHYDRO2HPYRROL2ONE
C1=CC=C(C=C1)C2=CC(=CC3=CC=C(C=C3)(N+)(=O)(O))C(=O)N2C4=CC=C(C=C4)SC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC29H19N3O5Sc332922(18206824(9720)31(34)35)1928(214213521)30(29)23101426(151123)3827161225(131727)32(36)37h119Hb2218
MFCD06666117
O=C1C(=Cc2ccc(cc2)(N+)(=O)(O))C=C(N1c1ccc(cc1)Sc1ccc(cc1)(N+)(=O)(O))c1ccccc1
ZINC000100191350
ZINC100191350
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