Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STK566136
SMILES C[NH+](CCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)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 C26H27N5O5 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O5/c1-17-21(16-27-30(17)19-10-5-4-6-11-19)24(32)22-23(18-9-7-12-20(15-18)31(35)36)29(26(34)25(22)33)14-8-13-28(2)3/h4-7,9-12,15-16,23,32H,8,13-14H2,1-3H3/b24-22+InChIKey
WHEHISHYJBDWHL-ZNTNEXAZSA-NSynonyms
955894-35-6(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5(3NITROPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)5(3NITROPHENYL)3PYRROLIN2ONE
955894356
C(NH+)(CCCN1C(c2cccc(c2)(N+)(=O)(O))C(=C(c2cnn(c2C)c2ccccc2)(O))C(=O)C1=O)C
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)(C)C)C4=CC(=CC=C4)(N+)(=O)(O))(O)
InChI=1SC26H27N5O5c11721(162730(17)19105461119)24(32)2223(18971220(1518)31(35)36)29(26(34)25(22)33)1481328(2)3h4791215162332H81314H213H3b2422+
MFCD18244958
ZINC000102539930
ZINC000102539936
Check stock
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