Vitas-M small molecule compound
2-[2-methyl-5-({(E)-[3-methyl-1-(naphthalen-1-yl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STL295740
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(c(c1)CN1C(=O)c2c(C1=O)cccc2)C)c1cccc2c1cccc2
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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 C31H24N4O3 MW 500.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N4O3/c1-19-14-15-23(16-22(19)18-34-29(36)25-11-5-6-12-26(25)30(34)37)32-17-27-20(2)33-35(31(27)38)28-13-7-9-21-8-3-4-10-24(21)28/h3-17,32H,18H2,1-2H3/b27-17+InChIKey
DFXSSZBZKJWVNO-WPWMEQJKSA-NSynonyms
2((2METHYL5(((E)(3METHYL1NAPHTHALEN1YL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)PHENYL)METHYL)ISOINDOLE13DIONE
2(2methyl5(((E)(3methyl1(naphthalen1yl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzyl)1Hisoindole13(2H)dione
CC1=C(C=C(C=C1)NC=C2C(=NN(C2=O)C3=CC=CC4=CC=CC=C43)C)CN5C(=O)C6=CC=CC=C6C5=O
CC1=NN(C(=O)C1=CNc1ccc(c(c1)CN1C(=O)c2c(C1=O)cccc2)C)c1cccc2c1cccc2
InChI=1SC31H24N4O3c119141523(1622(19)183429(36)2511561226(25)30(34)37)32172720(2)3335(31(27)38)281379218341024(21)28h31732H18H212H3b2717+
MFCD28033118
ZINC000101122743
ZINC08425491
ZINC101122743
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