Vitas-M small molecule compound
3-(2,3-dihydro-1-benzofuran-5-yl)-N-[(11aS)-11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl]propanamide
Catalog ID
STL538994
SMILES O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=N2)O)CCc1ccc2c(c1)CCO2
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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 C23H23N3O4 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O4/c27-21(8-4-14-3-7-20-15(12-14)9-11-30-20)24-16-5-6-18-17(13-16)23(29)26-10-1-2-19(26)22(28)25-18/h3,5-7,12-13,19H,1-2,4,8-11H2,(H,24,27)(H,25,28)/t19-/m0/s1InChIKey
CNEQYWHATCPCMP-IBGZPJMESA-NSynonyms
1574328-07-6~(N)((6~(a)~(S))611dioxo6~(a)789tetrahydro5~(H)pyrrolo(21c)(14)benzodiazepin2yl)3(23dihydro1benzofuran5yl)propanamide
1574328076
3(23dihydro1benzofuran5yl)N((11aS)11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)propanamide
71827247
InChI=1SC23H23N3O4c2721(8414372015(1214)9113020)2416561817(1316)23(29)26101219(26)22(28)2518h357121319H124811H2(H2427)(H2528)t19m0s1
ZINC000096113954
ZINC96113954
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