Vitas-M small molecule compound
2-[5-(3-chloro-4-methylphenyl)furan-2-yl]-4-oxo-1-phenyl-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Catalog ID
STL016755
SMILES N#CC1=C(S)N(C(NC1=O)c1ccc(o1)c1ccc(c(c1)Cl)C)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 C22H16ClN3O2S MW 421.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O2S/c1-13-7-8-14(11-17(13)23)18-9-10-19(28-18)20-25-21(27)16(12-24)22(29)26(20)15-5-3-2-4-6-15/h2-11,20,29H,1H3,(H,25,27)InChIKey
YDVSYXWEOMYECH-UHFFFAOYSA-NSynonyms
2(5(3CHLORO4METHYLPHENYL)(2FURYL))6OXO3PHENYL4SULFANYL123TRIHYDROPYRIMIDINE5CARBONITRILE
2(5(3chloro4methylphenyl)furan2yl)4oxo1phenyl6sulfanyl1234tetrahydropyrimidine5carbonitrile
2(5(3CHLORO4METHYLPHENYL)FURAN2YL)6OXO3PHENYL4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
CC1=C(C=C(C=C1)C2=CC=C(O2)C3NC(=O)C(=C(N3C4=CC=CC=C4)S)C#N)Cl
InChI=1SC22H16ClN3O2Sc1137814(1117(13)23)1891019(2818)202521(27)16(1224)22(29)26(20)155324615h2112029H1H3(H2527)
MFCD03289975
ZINC000001454021
ZINC000001454022
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