Vitas-M small molecule compound
diethyl 5-[(2E)-2-(3-amino-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK370664
SMILES CCOC(=O)c1c(N/N=C/2\C(=NN(C2=O)c2ccccc2)N)sc(c1C)C(=O)OCC
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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 C20H21N5O5S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O5S/c1-4-29-19(27)13-11(3)15(20(28)30-5-2)31-17(13)23-22-14-16(21)24-25(18(14)26)12-9-7-6-8-10-12/h6-10,23H,4-5H2,1-3H3,(H2,21,24)/b22-14+InChIKey
QATCFYALLKUORE-HYARGMPZSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NN=C2C(=NN(C2=O)C3=CC=CC=C3)N
CCOC(=O)c1c(NN=C2C(=NN(C2=O)c2ccccc2)N)sc(c1C)C(=O)OCC
diethyl5((2E)2(3amino5oxo1phenyl15dihydro4Hpyrazol4ylidene)hydrazinyl)3methylthiophene24dicarboxylate
DIETHYL5((2E)2(3AMINO5OXO1PHENYLPYRAZOL4YLIDENE)HYDRAZINYL)3METHYLTHIOPHENE24DICARBOXYLATE
ETHYL5(((3AMINO5OXO1PHENYL(12DIAZOLIN4YLIDENE))AZAMETHYL)AMINO)4(ETHOXYCARBONYL)3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC20H21N5O5Sc142919(27)1311(3)15(20(28)3052)3117(13)23221416(21)2425(18(14)26)1297681012h61023H45H213H3(H22124)b2214+
MFCD00706387
ZINC000100295864
ZINC2680202
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