Vitas-M small molecule compound
(8S,8aR,11aS)-8-[(4-chlorophenyl)carbonyl]-10-(3-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK548020
SMILES Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])cccc3
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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 C27H18ClN3O5 MW 499.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClN3O5/c28-17-10-8-16(9-11-17)25(32)24-22-21(23-20-7-2-1-4-15(20)12-13-29(23)24)26(33)30(27(22)34)18-5-3-6-19(14-18)31(35)36/h1-14,21-24H/t21-,22+,23?,24-/m0/s1InChIKey
RCLIYRAWEGKYHJ-UZLDWMDBSA-NSynonyms
956982-28-8(8S8aR11aS)8((4chlorophenyl)carbonyl)10(3nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(4chlorobenzoyl)10(3nitrophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956982288
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)C5=CC=C(C=C5)Cl)C(=O)N(C4=O)C6=CC(=CC=C6)(N+)(=O)(O)
Clc1ccc(cc1)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O))cccc3
InChI=1SC27H18ClN3O5c281710816(91117)25(32)242221(2320721415(20)121329(23)24)26(33)30(27(22)34)1853619(1418)31(35)36h1142124Ht2122+23?24m0s1
MFCD18242391
ZINC000016039435
ZINC000043716726
Check stock
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Check stock on Vitas-MAvailable files
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