Vitas-M small molecule compound
2-[5-(4-chlorophenyl)-7-(2-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK114267
SMILES COc1ccccc1C1C=C(Nc2n1nc(n2)N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1)Cl
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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 C26H18ClN5O3 MW 483.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClN5O3/c1-35-22-9-5-4-8-19(22)21-14-20(15-10-12-16(27)13-11-15)28-25-29-26(30-32(21)25)31-23(33)17-6-2-3-7-18(17)24(31)34/h2-14,21H,1H3,(H,28,29,30)InChIKey
XZLBWSJILYODCC-UHFFFAOYSA-NSynonyms
2(5(4CHLOROPHENYL)7(2METHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)ISOINDOLE13DIONE
2(5(4CHLOROPHENYL)7(2METHOXYPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)1HISOINDOLE13(2H)DIONE
COC1=CC=CC=C1C2C=C(N=C3N2NC(=N3)N4C(=O)C5=CC=CC=C5C4=O)C6=CC=C(C=C6)Cl
InChI=1SC26H18ClN5O3c13522954819(22)211420(15101216(27)131115)28252926(3032(21)25)3123(33)17623718(17)24(31)34h21421H1H3(H282930)
MFCD04127446
ZINC000101531017
ZINC000101531022
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