Vitas-M small molecule compound
2-[2-chloro-5-({(E)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STL295735
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(c(c1)CN1C(=O)c2c(C1=O)cccc2)Cl)c1ccc(c(c1)C)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 C28H23ClN4O3 MW 498.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O3/c1-16-8-10-21(12-17(16)2)33-28(36)24(18(3)31-33)14-30-20-9-11-25(29)19(13-20)15-32-26(34)22-6-4-5-7-23(22)27(32)35/h4-14,30H,15H2,1-3H3/b24-14+InChIKey
MUEYKTKBVUKCQE-ZVHZXABRSA-NSynonyms
2((2chloro5(((E)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)phenyl)methyl)isoindole13dione
2(2chloro5(((E)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzyl)1Hisoindole13(2H)dione
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)Cl)CN4C(=O)C5=CC=CC=C5C4=O)C(=N2)C)C
CC1=NN(C(=O)C1=CNc1ccc(c(c1)CN1C(=O)c2c(C1=O)cccc2)Cl)c1ccc(c(c1)C)C
InChI=1SC28H23ClN4O3c11681021(1217(16)2)3328(36)24(18(3)3133)14302091125(29)19(1320)153226(34)22645723(22)27(32)35h41430H15H213H3b2414+
MFCD28033113
ZINC000008435393
ZINC08435393
ZINC8435393
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