Vitas-M small molecule compound
(8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(2-methoxyphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK545240
SMILES COc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2
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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 C28H21ClN2O4 MW 484.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClN2O4/c1-35-21-9-5-4-8-20(21)31-27(33)22-23(28(31)34)25(26(32)17-10-12-18(29)13-11-17)30-15-14-16-6-2-3-7-19(16)24(22)30/h2-15,22-25H,1H3/t22-,23+,24?,25-/m0/s1InChIKey
DDBKDPYPFMKXPG-NPZNXQLHSA-NSynonyms
1014082-45-1(8S8aR11aS)8((4chlorophenyl)carbonyl)10(2methoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(4chlorobenzoyl)10(2methoxyphenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1014082451
COC1=CC=CC=C1N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=C(C=C6)Cl
COc1ccccc1N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2
InChI=1SC28H21ClN2O4c13521954820(21)3127(33)2223(28(31)34)25(26(32)17101218(29)131117)30151416623719(16)24(22)30h2152225H1H3t2223+24?25m0s1
MFCD18242205
ZINC000018144578
ZINC000034849584
Check stock
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Check stock on Vitas-MAvailable files
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