Vitas-M small molecule compound

2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide

Catalog ID
STK209121
SMILES CCOc1ccc2c(c1)sc(n2)NC(=O)CSc1nc(c2ccccc2)c(c(=O)[nH]1)C#N

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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 C22H17N5O3S2 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O3S2/c1-2-30-14-8-9-16-17(10-14)32-22(24-16)25-18(28)12-31-21-26-19(13-6-4-3-5-7-13)15(11-23)20(29)27-21/h3-10H,2,12H2,1H3,(H,24,25,28)(H,26,27,29)
InChIKey
MGIHBMLNJBQIJZ-UHFFFAOYSA-N
Synonyms

2((5CYANO4KETO6PHENYL1HPYRIMIDIN2YL)THIO)N(6ETHOXY13BENZOTHIAZOL2YL)ACETAMIDE
2((5CYANO4OXIDANYLIDENE6PHENYL1HPYRIMIDIN2YL)SULFANYL)N(6ETHOXY13BENZOTHIAZOL2YL)ETHANAMIDE
2((5CYANO4OXO6PHENYL1HPYRIMIDIN2YL)SULFANYL)N(6ETHOXY13BENZOTHIAZOL2YL)ACETAMIDE
2((5CYANO4OXO6PHENYL1HPYRIMIDIN2YL)THIO)N(6ETHOXY13BENZOTHIAZOL2YL)ACETAMIDE
2((5CYANO6OXO4PHENYL16DIHYDRO2PYRIMIDINYL)THIO)N(6ETHOXY13BENZOTHIAZOL2YL)ACETAMIDE
2((5CYANO6OXO4PHENYL16DIHYDROPYRIMIDIN2YL)SULFANYL)N(6ETHOXY13BENZOTHIAZOL2YL)ACETAMIDE
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=O)C(=C(N3)C4=CC=CC=C4)C#N
CCOc1ccc2c(c1)sc(n2)NC(=O)CSc1nc(c2ccccc2)c(c(=O)(nH)1)C#N
InChI=1SC22H17N5O3S2c123014891617(1014)3222(2416)2518(28)1231212619(136435713)15(1123)20(29)2721h310H212H21H3(H242528)(H262729)
MFCD06005729
ZINC000012730895
ZINC12730895

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Available files

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