Vitas-M small molecule compound
(1'S,2'S,3R,3a'R)-5'-methyl-1'-[(4-nitrophenyl)carbonyl]-2'-(pyridin-4-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL054595
SMILES O=C([C@H]1N2c3ccccc3C(=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)C)c1ccc(cc1)[N+](=O)[O-]
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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 C33H24N4O5 MW 556.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24N4O5/c1-19-18-27-33(24-7-3-4-8-25(24)35-32(33)40)28(30(38)21-14-16-34-17-15-21)29(36(27)26-9-5-2-6-23(19)26)31(39)20-10-12-22(13-11-20)37(41)42/h2-18,27-29H,1H3,(H,35,40)/t27-,28+,29+,33-/m1/s1InChIKey
ZMPULFICGYXEER-UUQNIDNHSA-NSynonyms
(1S2S3R3aR)2isonicotinoyl5methyl1(4nitrobenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
(1S2S3R3aR)5methyl1((4nitrophenyl)carbonyl)2(pyridin4ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)5methyl1(4nitrobenzoyl)2(pyridine4carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC1=CC2C3(C(C(N2C4=CC=CC=C14)C(=O)C5=CC=C(C=C5)(N+)(=O)(O))C(=O)C6=CC=NC=C6)C7=CC=CC=C7NC3=O
InChI=1SC33H24N4O5c119182733(24734825(24)3532(33)40)28(30(38)21141634171521)29(36(27)26952623(19)26)31(39)20101222(131120)37(41)42h2182729H1H3(H3540)t2728+29+33m1s1
MFCD18192744
O=C((C@H)1N2c3ccccc3C(=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000102893834
ZINC102893834
Check stock
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Check stock on Vitas-MAvailable files
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