Vitas-M small molecule compound
2-[5-(3-chlorophenyl)furan-2-yl]-1-(4-methoxyphenyl)-4-oxo-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Catalog ID
STK950001
SMILES N#CC1=C(S)N(C(NC1=O)c1ccc(o1)c1cccc(c1)Cl)c1ccc(cc1)OC
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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 C22H16ClN3O3S MW 437.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S/c1-28-16-7-5-15(6-8-16)26-20(25-21(27)17(12-24)22(26)30)19-10-9-18(29-19)13-3-2-4-14(23)11-13/h2-11,20,30H,1H3,(H,25,27)InChIKey
ZDUBMXMZOHGYCI-UHFFFAOYSA-NSynonyms
2(5(3CHLOROPHENYL)(2FURYL))3(4METHOXYPHENYL)6OXO4SULFANYL123TRIHYDROPYRIMIDINE5CARBONITRILE
2(5(3chlorophenyl)furan2yl)1(4methoxyphenyl)4oxo6sulfanyl1234tetrahydropyrimidine5carbonitrile
2(5(3CHLOROPHENYL)FURAN2YL)3(4METHOXYPHENYL)6OXO4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
COC1=CC=C(C=C1)N2C(NC(=O)C(=C2S)C#N)C3=CC=C(O3)C4=CC(=CC=C4)Cl
InChI=1SC22H16ClN3O3Sc128167515(6816)2620(2521(27)17(1224)22(26)30)1910918(2919)1332414(23)1113h2112030H1H3(H2527)
MFCD06303265
ZINC000012042988
ZINC000012042989
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