Vitas-M small molecule compound
N-(3,4-dichlorophenyl)-2-[(2S,11aS)-2-hydroxy-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Catalog ID
STK612097
SMILES O[C@H]1C[C@@H]2N(C1)C(=O)c1c(N(C2=O)CC(=O)Nc2ccc(c(c2)Cl)Cl)cccc1
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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 C20H17Cl2N3O4 MW 434.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2N3O4/c21-14-6-5-11(7-15(14)22)23-18(27)10-25-16-4-2-1-3-13(16)19(28)24-9-12(26)8-17(24)20(25)29/h1-7,12,17,26H,8-10H2,(H,23,27)/t12-,17-/m0/s1InChIKey
LIKCMBUXGPKNKA-SJCJKPOMSA-NSynonyms
1014086-88-41014086884
2((6aS8S)8hydroxy611dioxo6a789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)N(34dichlorophenyl)acetamide
C1C(CN2C1C(=O)N(C3=CC=CC=C3C2=O)CC(=O)NC4=CC(=C(C=C4)Cl)Cl)O
InChI=1SC20H17Cl2N3O4c21146511(715(14)22)2318(27)102516421313(16)19(28)24912(26)817(24)20(25)29h17121726H810H2(H2327)t1217m0s1
MFCD18246274
N(34dichlorophenyl)2((2S11aS)2hydroxy511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)acetamide
N(34dichlorophenyl)2((2S11aS)2hydroxy511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetamide
O(C@H)1C(C@@H)2N(C1)C(=O)c1c(N(C2=O)CC(=O)Nc2ccc(c(c2)Cl)Cl)cccc1
ZINC000009305043
ZINC09305043
ZINC9305043
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.