Vitas-M small molecule compound
(4E)-5-(3-chlorophenyl)-1-[2-(dimethylamino)ethyl]-4-[hydroxy(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK634667
SMILES CN(CCN1C(=O)C(=O)/C(=C(\c2c(C)nn(c2C)C)/O)/C1c1cccc(c1)Cl)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 C21H25ClN4O3 MW 416.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4O3/c1-12-16(13(2)25(5)23-12)19(27)17-18(14-7-6-8-15(22)11-14)26(10-9-24(3)4)21(29)20(17)28/h6-8,11,18,27H,9-10H2,1-5H3/b19-17+InChIKey
IBMHQGZIYGMFFM-HTXNQAPBSA-NSynonyms
1010864-34-2(4E)5(3chlorophenyl)1(2(dimethylamino)ethyl)4(hydroxy(135trimethyl1Hpyrazol4yl)methylidene)pyrrolidine23dione
(4E)5(3chlorophenyl)1(2(dimethylamino)ethyl)4(hydroxy(135trimethylpyrazol4yl)methylidene)pyrrolidine23dione
1010864342
CC1=C(C(=NN1C)C)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)Cl)O
CN(CCN1C(=O)C(=O)C(=C(c2c(C)nn(c2C)C)O)C1c1cccc(c1)Cl)C
InChI=1SC21H25ClN4O3c11216(13(2)25(5)2312)19(27)1718(1476815(22)1114)26(10924(3)4)21(29)20(17)28h68111827H910H215H3b1917+
MFCD18160468
ZINC000102738531
ZINC000102738534
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