Vitas-M small molecule compound

N-{2-hydroxy-3-[2-(methylsulfanyl)ethyl]-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-7-yl}-2-[1-(1H-pyrrol-1-yl)cyclohexyl]acetamide

Catalog ID
STL541122
SMILES CSCCC1NC(=O)c2c(N=C1O)ccc(c2)NC(=O)CC1(CCCCC1)n1cccc1

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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 C24H30N4O3S MW 454.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O3S/c1-32-14-9-20-23(31)26-19-8-7-17(15-18(19)22(30)27-20)25-21(29)16-24(10-3-2-4-11-24)28-12-5-6-13-28/h5-8,12-13,15,20H,2-4,9-11,14,16H2,1H3,(H,25,29)(H,26,31)(H,27,30)
InChIKey
HPXRNYPFOAKSEH-UHFFFAOYSA-N
Synonyms

~(N)(3(2methylsulfanylethyl)25dioxo34dihydro1~(H)14benzodiazepin7yl)2(1pyrrol1ylcyclohexyl)acetamide
75357137
MFCD31755254
N(2hydroxy3(2(methylsulfanyl)ethyl)5oxo45dihydro3H14benzodiazepin7yl)2(1(1Hpyrrol1yl)cyclohexyl)acetamide
ZINC000096221792
ZINC000206254920

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Available files

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