Vitas-M small molecule compound
N-(2-chloro-5-nitrophenyl)-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)propanamide
Catalog ID
STK260302
SMILES O=C(Nc1cc(ccc1Cl)[N+](=O)[O-])CCN1C(=O)C2C(C1=O)CC=CC2
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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 C17H16ClN3O5 MW 377.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O5/c18-13-6-5-10(21(25)26)9-14(13)19-15(22)7-8-20-16(23)11-3-1-2-4-12(11)17(20)24/h1-2,5-6,9,11-12H,3-4,7-8H2,(H,19,22)InChIKey
WTKQCEICXMDJAY-UHFFFAOYSA-NSynonyms
C1C=CCC2C1C(=O)N(C2=O)CCC(=O)NC3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC17H16ClN3O5c18136510(21(25)26)914(13)1915(22)782016(23)11312412(11)17(20)24h125691112H3478H2(H1922)
MFCD08681340
N(2chloro5nitrophenyl)3(13dioxo133a477ahexahydro2Hisoindol2yl)propanamide
N(2chloro5nitrophenyl)3(13dioxo3a477atetrahydroisoindol2yl)propanamide
O=C(Nc1cc(ccc1Cl)(N+)(=O)(O))CCN1C(=O)C2C(C1=O)CC=CC2
ZINC000018244172
ZINC000100099857
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