Vitas-M small molecule compound
2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(4-methoxy-2-nitrophenyl)-3-phenylpropanamide
Catalog ID
STK257984
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)C(N1C(=O)C2C(C1=O)C1CC2C=C1)Cc1ccccc1
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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 C25H23N3O6 MW 461.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6/c1-34-17-9-10-18(19(13-17)28(32)33)26-23(29)20(11-14-5-3-2-4-6-14)27-24(30)21-15-7-8-16(12-15)22(21)25(27)31/h2-10,13,15-16,20-22H,11-12H2,1H3,(H,26,29)InChIKey
KKLKJXXWGFHFEQ-UHFFFAOYSA-NSynonyms
2(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)N(4METHOXY2NITROPHENYL)3PHENYLPROPANAMIDE
COC1=CC(=C(C=C1)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)C(N1C(=O)C2C(C1=O)C1CC2C=C1)Cc1ccccc1
InChI=1SC25H23N3O6c1341791018(19(1317)28(32)33)2623(29)20(11145324614)2724(30)21157816(1215)22(21)25(27)31h2101315162022H1112H21H3(H2629)
MFCD03104020
ZINC000101071214
ZINC000239331282
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