Vitas-M small molecule compound

N-(3,4-dichlorophenyl)-2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide

Catalog ID
STK611131
SMILES O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)Nc1ccc(c(c1)Cl)Cl

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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 C20H17Cl2N3O3 MW 418.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2N3O3/c21-14-8-7-12(10-15(14)22)23-18(26)11-25-16-5-2-1-4-13(16)19(27)24-9-3-6-17(24)20(25)28/h1-2,4-5,7-8,10,17H,3,6,9,11H2,(H,23,26)/t17-/m0/s1
InChIKey
TWYRMBRRPSPTTD-KRWDZBQOSA-N
Synonyms
1014063-45-6
(S)N(34dichlorophenyl)2(511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)acetamide
1014063456
2((6aS)611dioxo6a789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)N(34dichlorophenyl)acetamide
C1CC2C(=O)N(C3=CC=CC=C3C(=O)N2C1)CC(=O)NC4=CC(=C(C=C4)Cl)Cl
InChI=1SC20H17Cl2N3O3c21148712(1015(14)22)2318(26)112516521413(16)19(27)2493617(24)20(25)28h1245781017H36911H2(H2326)t17m0s1
MFCD08746310
N(34dichlorophenyl)2((11aS)511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetamide
O=C(CN1C(=O)(C@@H)2CCCN2C(=O)c2c1cccc2)Nc1ccc(c(c1)Cl)Cl
ZINC000009303551
ZINC09303551
ZINC9303551

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.