Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-nitrophenyl)-9,11-dioxo-N-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK554812
SMILES O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)[N+](=O)[O-])Nc1ccccc1
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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 C27H20N4O5 MW 480.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O5/c32-25(28-17-7-2-1-3-8-17)24-22-21(23-20-9-5-4-6-16(20)14-15-29(23)24)26(33)30(27(22)34)18-10-12-19(13-11-18)31(35)36/h1-15,21-24H,(H,28,32)/t21-,22+,23+,24-/m0/s1InChIKey
VXNPWLSUMVHERL-KEZOAJOQSA-NSynonyms
1013794-16-5(8S8aR11aS11bS)10(4nitrophenyl)911dioxoNphenyl8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1013794165
C1=CC=C(C=C1)NC(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H20N4O5c3225(28177213817)242221(2320954616(20)141529(23)24)26(33)30(27(22)34)18101219(131118)31(35)36h1152124H(H2832)t2122+23+24m0s1
MFCD18242828
O=C((C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(cc1)(N+)(=O)(O))Nc1ccccc1
ZINC000027373618
ZINC27373618
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