Vitas-M small molecule compound
methyl 7-methyl-5-(4-methylphenyl)-4-oxo-2-(prop-2-en-1-ylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981066
SMILES C=CCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1ccc(cc1)C)C(=O)OC)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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-5-10-27-20-22-17-16(18(24)23-20)15(13-8-6-11(2)7-9-13)14(12(3)21-17)19(25)26-4/h5-9,15H,1,10H2,2-4H3,(H2,21,22,23,24)InChIKey
PFQKTDFHLRJQAB-UHFFFAOYSA-NSynonyms
C=CCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1ccc(cc1)C)C(=O)OC)C
CC1=CC=C(C=C1)C2C3=C(NC(=C2C(=O)OC)C)NC(=NC3=O)SCC=C
InChI=1SC20H21N3O3Sc15102720221716(18(24)2320)15(138611(2)7913)14(12(3)2117)19(25)264h5915H110H224H3(H221222324)
methyl7methyl5(4methylphenyl)4oxo2(prop2en1ylsulfanyl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
methyl7methyl5(4methylphenyl)4oxo2prop2enylsulfanyl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
MFCD07803243
ZINC000004292273
ZINC000004292274
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