Vitas-M small molecule compound
ethyl 4-[4-(naphthalen-1-ylmethoxy)phenyl]-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL426977
SMILES CCOC(=O)C1=C(NC(=S)NC1c1ccc(cc1)OCc1cccc2c1cccc2)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 C30H26N2O3S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O3S/c1-2-34-29(33)26-27(21-10-4-3-5-11-21)31-30(36)32-28(26)22-15-17-24(18-16-22)35-19-23-13-8-12-20-9-6-7-14-25(20)23/h3-18,28H,2,19H2,1H3,(H2,31,32,36)InChIKey
LDKHVZSGSZIQTP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5
ethyl4(4(naphthalen1ylmethoxy)phenyl)6phenyl2sulfanylidene34dihydro1Hpyrimidine5carboxylate
ethyl4(4(naphthalen1ylmethoxy)phenyl)6phenyl2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC30H26N2O3Sc123429(33)2627(21104351121)3130(36)3228(26)22151724(181622)35192313812209671425(20)23h31828H219H21H3(H2313236)
MFCD08578736
ZINC000020423868
ZINC000020423870
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