Vitas-M small molecule compound

N-(2,5-dimethylphenyl)-2-[(6-methyl-2-phenylpyrimidin-4-yl)sulfanyl]acetamide

Catalog ID
STL083722
SMILES O=C(Nc1cc(C)ccc1C)CSc1cc(C)nc(n1)c1ccccc1

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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 C21H21N3OS MW 363.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3OS/c1-14-9-10-15(2)18(11-14)23-19(25)13-26-20-12-16(3)22-21(24-20)17-7-5-4-6-8-17/h4-12H,13H2,1-3H3,(H,23,25)
InChIKey
YHXRRDWFYLWTKF-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NC(=NC(=C2)C)C3=CC=CC=C3
InChI=1SC21H21N3OSc11491015(2)18(1114)2319(25)1326201216(3)2221(2420)177546817h412H13H213H3(H2325)
MFCD18202429
N(25dimethylphenyl)2((6methyl2phenylpyrimidin4yl)sulfanyl)acetamide
N(25dimethylphenyl)2(6methyl2phenylpyrimidin4yl)sulfanylacetamide
ZINC000057519776
ZINC57519776

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Available files

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