Vitas-M small molecule compound

N~2~-benzyl-N-(2,4-dimethoxyphenyl)-N~2~-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}-2-methylalaninamide

Catalog ID
STL446953
SMILES COc1ccc(c(c1)OC)NC(=O)C(N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1)(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 C27H32N4O4S MW 508.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O4S/c1-18-14-19(2)29-26(28-18)36-17-24(32)31(16-20-10-8-7-9-11-20)27(3,4)25(33)30-22-13-12-21(34-5)15-23(22)35-6/h7-15H,16-17H2,1-6H3,(H,30,33)
InChIKey
WMIOCXBXFOUTON-UHFFFAOYSA-N
Synonyms

2(BENZYL(2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)N(24DIMETHOXYPHENYL)2METHYLPROPANAMIDE
2(NBENZYL2(46DIMETHYLPYRIMIDIN2YLTHIO)ACETAMIDO)N(24DIMETHOXYPHENYL)2METHYLPROPANAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C(=O)NC3=C(C=C(C=C3)OC)OC)C
InChI=1SC27H32N4O4Sc1181419(2)2926(2818)361724(32)31(1620108791120)27(34)25(33)3022131221(345)1523(22)356h715H1617H216H3(H3033)
MFCD06243546
N~2~benzylN(24dimethoxyphenyl)N~2~(((46dimethylpyrimidin2yl)sulfanyl)acetyl)2methylalaninamide
N2BENZYLN(24DIMETHOXYPHENYL)N2(((46DIMETHYLPYRIMIDIN2YL)SULFANYL)ACETYL)2METHYLALANINAMIDE
ZINC000001407232
ZINC1407232

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Available files

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