Vitas-M small molecule compound

2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4,6-dimethoxypyrimidin-2-yl)acetamide

Catalog ID
STK149922
SMILES COc1cc(OC)nc(n1)NC(=O)CSc1nnc(n1C1CCCCC1)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 C22H26N6O3S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O3S/c1-30-18-13-19(31-2)25-21(24-18)23-17(29)14-32-22-27-26-20(15-9-5-3-6-10-15)28(22)16-11-7-4-8-12-16/h3,5-6,9-10,13,16H,4,7-8,11-12,14H2,1-2H3,(H,23,24,25,29)
InChIKey
GMNBJJDCWZMJEG-UHFFFAOYSA-N
Synonyms
517869-83-9
2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)SULFANYL)N(46DIMETHOXYPYRIMIDIN2YL)ACETAMIDE
2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)SULFANYL)N(46DIMETHOXYPYRIMIDIN2YL)ETHANAMIDE
2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)THIO)N(46DIMETHOXY2PYRIMIDINYL)ACETAMIDE
2((4CYCLOHEXYL5PHENYL124TRIAZOL3YL)THIO)N(46DIMETHOXYPYRIMIDIN2YL)ACETAMIDE
2((4CYCLOHEXYL5PHENYL4H124TRIAZOL3YL)SULFANYL)N(46DIMETHOXYPYRIMIDIN2YL)ACETAMIDE
2((4CYCLOHEXYL5PHENYL4H124TRIAZOL3YL)THIO)N(46DIMETHOXY2PYRIMIDINYL)ACETAMIDE
2((4cyclohexyl5phenyl4H124triazol3yl)thio)N(46dimethoxypyrimidin2yl)acetamide
517869839
COC1=CC(=NC(=N1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4)OC
InChI=1SC22H26N6O3Sc130181319(312)2521(2418)2317(29)143222272620(1595361015)28(22)16117481216h3569101316H478111214H212H3(H23242529)
MFCD03778933
N(46DIMETHOXYPYRIMIDIN2YL)2(4CYCLOHEXYL5PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000004197125
ZINC04197125
ZINC4197125

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Available files

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