Vitas-M small molecule compound

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

Catalog ID
STL408490
SMILES CSCCC(c1nc2c([nH]1)cccc2)NC(=O)CC1NC(=O)c2c1cccc2

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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-28-11-10-17(20-23-15-8-4-5-9-16(15)24-20)22-19(26)12-18-13-6-2-3-7-14(13)21(27)25-18/h2-9,17-18H,10-12H2,1H3,(H,22,26)(H,23,24)(H,25,27)
InChIKey
SVLUPRUZOMGFAP-UHFFFAOYSA-N
Synonyms

CSCC(C@@H)(c1nc2c((nH)1)cccc2)NC(=O)CC1NC(=O)c2c1cccc2
CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CC3C4=CC=CC=C4C(=O)N3
CSCCC(c1nc2c((nH)1)cccc2)NC(=O)CC1NC(=O)c2c1cccc2
InChI=1SC21H22N4O2Sc128111017(202315845916(15)2420)2219(26)121813623714(13)21(27)2518h291718H1012H21H3(H2226)(H2324)(H2527)
MFCD30705245
N((S)1(1Hbenzo(d)imidazol2yl)3(methylthio)propyl)2(3oxoisoindolin1yl)acetamide
N(1(1Hbenzimidazol2yl)3(methylsulfanyl)propyl)2(3oxo23dihydro1Hisoindol1yl)acetamide
N(1(1Hbenzimidazol2yl)3methylsulfanylpropyl)2(3oxo12dihydroisoindol1yl)acetamide
ZINC000096232372
ZINC000223220858

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Available files

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