Vitas-M small molecule compound
methyl 2-(butylsulfanyl)-7-methyl-5-(4-methylphenyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981068
SMILES CCCCSc1nc2NC(=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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-5-6-11-28-21-23-18-17(19(25)24-21)16(14-9-7-12(2)8-10-14)15(13(3)22-18)20(26)27-4/h7-10,16H,5-6,11H2,1-4H3,(H2,22,23,24,25)InChIKey
BTPHHBWZIXZVBI-UHFFFAOYSA-NSynonyms
876865-84-8876865848
CCCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CC=C(C=C3)C)C(=O)OC)C
CCCCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1ccc(cc1)C)C(=O)OC)C
InChI=1SC21H25N3O3Sc156112821231817(19(25)2421)16(149712(2)81014)15(13(3)2218)20(26)274h71016H5611H214H3(H222232425)
methyl2(butylsulfanyl)7methyl5(4methylphenyl)4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
methyl2butylsulfanyl7methyl5(4methylphenyl)4oxo58dihydro1Hpyrido(23d)pyrimidine6carboxylate
MFCD07803238
ZINC000004292265
ZINC000004292266
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