Vitas-M small molecule compound

phenyl 2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-1H-benzimidazole-1-carboxylate

Catalog ID
STK758997
SMILES CCN(C(=O)CSc1nc2c(n1C(=O)Oc1ccccc1)cccc2)CC

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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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-3-22(4-2)18(24)14-27-19-21-16-12-8-9-13-17(16)23(19)20(25)26-15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3
InChIKey
RFYNHEOJLKFYSU-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)CSC1=NC2=CC=CC=C2N1C(=O)OC3=CC=CC=C3
InChI=1SC20H21N3O3Sc1322(42)18(24)142719211612891317(16)23(19)20(25)2615106571115h513H3414H212H3
MFCD01460585
phenyl2((2(diethylamino)2oxoethyl)sulfanyl)1Hbenzimidazole1carboxylate
PHENYL2((NNDIETHYLCARBAMOYL)METHYLTHIO)BENZIMIDAZOLECARBOXYLATE
PHENYL2(2(DIETHYLAMINO)2OXOETHYL)SULFANYLBENZIMIDAZOLE1CARBOXYLATE
ZINC000000714232
ZINC00714232
ZINC714232

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Available files

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