Vitas-M small molecule compound
methyl 4-[3-methyl-5-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate
Catalog ID
STL062145
SMILES COC(=O)c1ccc(cc1)C1N(c2ccc(cc2)C)C(=O)c2c1c(C)n[nH]2
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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 C21H19N3O3 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3/c1-12-4-10-16(11-5-12)24-19(17-13(2)22-23-18(17)20(24)25)14-6-8-15(9-7-14)21(26)27-3/h4-11,19H,1-3H3,(H,22,23)InChIKey
QQXYVCDNGJFOJM-UHFFFAOYSA-NSynonyms
573705-93-8573705938
CC1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC=C(C=C4)C(=O)OC
COC(=O)c1ccc(cc1)C1N(c2ccc(cc2)C)C(=O)c2c1c(C)n(nH)2
InChI=1SC21H19N3O3c11241016(11512)2419(1713(2)222318(17)20(24)25)146815(9714)21(26)273h41119H13H3(H2223)
methyl4(3methyl5(4methylphenyl)6oxo1456tetrahydropyrrolo(34c)pyrazol4yl)benzoate
METHYL4(3METHYL5(4METHYLPHENYL)6OXO24DIHYDROPYRROLO(34C)PYRAZOL4YL)BENZOATE
methyl4(3methyl6oxo5(ptolyl)1456tetrahydropyrrolo(34c)pyrazol4yl)benzoate
MFCD04018052
ZINC000004928771
ZINC000004928772
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