Vitas-M small molecule compound
N-(2,4-dimethoxyphenyl)-2-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl](pyridin-3-ylmethyl)amino}-1,2,3,4,4a,9,9a,10-octahydroanthracene-2-carboxamide
Catalog ID
STL439313
SMILES COc1ccc(c(c1)OC)NC(=O)C1(CCC2C(C1)Cc1c(C2)cccc1)N(C(=O)CN1C(=O)c2c(C1=O)cccc2)Cc1cccnc1
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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 C39H38N4O6 MW 658.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H38N4O6/c1-48-30-13-14-33(34(20-30)49-2)41-38(47)39(16-15-28-18-26-9-3-4-10-27(26)19-29(28)21-39)43(23-25-8-7-17-40-22-25)35(44)24-42-36(45)31-11-5-6-12-32(31)37(42)46/h3-14,17,20,22,28-29H,15-16,18-19,21,23-24H2,1-2H3,(H,41,47)InChIKey
OFMQBQWRCLNTDB-UHFFFAOYSA-NSynonyms
COC1=CC(=C(C=C1)NC(=O)C2(CCC3CC4=CC=CC=C4CC3C2)N(CC5=CN=CC=C5)C(=O)CN6C(=O)C7=CC=CC=C7C6=O)OC
InChI=1SC39H38N4O6c14830131433(34(2030)492)4138(47)39(16152818269341027(26)1929(28)2139)43(23258717402225)35(44)244236(45)3111561232(31)37(42)46h3141720222829H15161819212324H212H3(H4147)
MFCD29709719
N(24dimethoxyphenyl)2(((13dioxo13dihydro2Hisoindol2yl)acetyl)(pyridin3ylmethyl)amino)12344a99a10octahydroanthracene2carboxamide
N(24DIMETHOXYPHENYL)2((2(13DIOXOISOINDOL2YL)ACETYL)(PYRIDIN3YLMETHYL)AMINO)344A99A10HEXAHYDRO1HANTHRACENE2CARBOXAMIDE
ZINC000150346537
ZINC000254445031
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