Vitas-M small molecule compound

N-[1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)propanamide

Catalog ID
STL424210
SMILES CSCCC(c1nc2c(n1C)cccc2)NC(=O)C(N1Cc2c(C1=O)cccc2)C

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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 C23H26N4O2S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S/c1-15(27-14-16-8-4-5-9-17(16)23(27)29)22(28)25-19(12-13-30-3)21-24-18-10-6-7-11-20(18)26(21)2/h4-11,15,19H,12-14H2,1-3H3,(H,25,28)
InChIKey
OCLWUBCYUVFAOI-UHFFFAOYSA-N
Synonyms

(S)N((S)1(1methyl1Hbenzo(d)imidazol2yl)3(methylthio)propyl)2(1oxoisoindolin2yl)propanamide
CC(C(=O)NC(CCSC)C1=NC2=CC=CC=C2N1C)N3CC4=CC=CC=C4C3=O
CSCC(C@@H)(c1nc2c(n1C)cccc2)NC(=O)(C@@H)(N1Cc2c(C1=O)cccc2)C
InChI=1SC23H26N4O2Sc115(271416845917(16)23(27)29)22(28)2519(1213303)21241810671120(18)26(21)2h4111519H1214H213H3(H2528)
MFCD30709239
N(1(1methyl1Hbenzimidazol2yl)3(methylsulfanyl)propyl)2(1oxo13dihydro2Hisoindol2yl)propanamide
N(1(1methylbenzimidazol2yl)3methylsulfanylpropyl)2(3oxo1Hisoindol2yl)propanamide
ZINC000218364798
ZINC000252539488

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Available files

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