Vitas-M small molecule compound

2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-(2-methylphenyl)propanamide

Catalog ID
STK497718
SMILES O=C(C(Sc1nc2c([nH]1)ccc(c2)C)C)Nc1ccccc1C

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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 C18H19N3OS MW 325.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3OS/c1-11-8-9-15-16(10-11)21-18(20-15)23-13(3)17(22)19-14-7-5-4-6-12(14)2/h4-10,13H,1-3H3,(H,19,22)(H,20,21)
InChIKey
JZXGXYIEEKJMAY-UHFFFAOYSA-N
Synonyms

2((5methyl1Hbenzimidazol2yl)sulfanyl)N(2methylphenyl)propanamide
2((6methyl1Hbenzimidazol2yl)sulfanyl)N(2methylphenyl)propanamide
CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC3=CC=CC=C3C
InChI=1SC18H19N3OSc111891516(1011)2118(2015)2313(3)17(22)1914754612(14)2h41013H13H3(H1922)(H2021)
MFCD08220198
O=C(C(Sc1nc2c((nH)1)ccc(c2)C)C)Nc1ccccc1C
ZINC000009371871
ZINC000009371872

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Available files

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