Vitas-M small molecule compound

N-[4-(dimethylamino)phenyl]-N~2~-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}-N~2~-(4-methylbenzyl)isovalinamide

Catalog ID
STL437600
SMILES CCC(N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccc(cc1)C)(C(=O)Nc1ccc(cc1)N(C)C)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 C29H37N5O2S MW 519.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37N5O2S/c1-8-29(5,27(36)32-24-13-15-25(16-14-24)33(6)7)34(18-23-11-9-20(2)10-12-23)26(35)19-37-28-30-21(3)17-22(4)31-28/h9-17H,8,18-19H2,1-7H3,(H,32,36)
InChIKey
IPZOMIYVZQTSCG-UHFFFAOYSA-N
Synonyms

CCC(C)(C(=O)NC1=CC=C(C=C1)N(C)C)N(CC2=CC=C(C=C2)C)C(=O)CSC3=NC(=CC(=N3)C)C
InChI=1SC29H37N5O2Sc1829(527(36)3224131525(161424)33(6)7)34(182311920(2)101223)26(35)1937283021(3)1722(4)3128h917H81819H217H3(H3236)
MFCD06243716
N(4(dimethylamino)phenyl)2((2(46dimethylpyrimidin2yl)sulfanylacetyl)((4methylphenyl)methyl)amino)2methylbutanamide
N(4(DIMETHYLAMINO)PHENYL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(4METHYLBENZYL)ACETAMIDO)2METHYLBUTANAMIDE
N(4(dimethylamino)phenyl)N~2~(((46dimethylpyrimidin2yl)sulfanyl)acetyl)N~2~(4methylbenzyl)isovalinamide
N(4DIMETHYLAMINOPHENYL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4METHYLPHENYL)METHYL)AMINO)2METHYLBUTANAMIDE
ZINC000001407677
ZINC000001407678

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Available files

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