Vitas-M small molecule compound
7-(4-methylphenyl)-4-oxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylic acid
Catalog ID
STL179899
SMILES C=CCn1c(S)nc(=O)c2c1nc(cc2C(=O)O)c1ccc(cc1)C
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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 C18H15N3O3S MW 353.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O3S/c1-3-8-21-15-14(16(22)20-18(21)25)12(17(23)24)9-13(19-15)11-6-4-10(2)5-7-11/h3-7,9H,1,8H2,2H3,(H,23,24)(H,20,22,25)InChIKey
UNPILKQPQYWFMH-UHFFFAOYSA-NSynonyms
1011391-18-61011391186
7(4methylphenyl)4oxo1(prop2en1yl)2sulfanyl14dihydropyrido(23d)pyrimidine5carboxylicacid
7(4methylphenyl)4oxo1prop2enyl2sulfanylidenepyrido(23d)pyrimidine5carboxylicacid
CC1=CC=C(C=C1)C2=NC3=C(C(=C2)C(=O)O)C(=O)NC(=S)N3CC=C
InChI=1SC18H15N3O3Sc138211514(16(22)2018(21)25)12(17(23)24)913(1915)116410(2)5711h379H18H22H3(H2324)(H202225)
MFCD09473146
ZINC000020615921
ZINC20615921
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