Vitas-M small molecule compound
propan-2-yl 7-methyl-5-(3-methylthiophen-2-yl)-4-oxo-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981027
SMILES CCCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1sccc1C)C(=O)OC(C)C)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 C20H25N3O3S2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S2/c1-6-8-28-20-22-17-15(18(24)23-20)14(16-11(4)7-9-27-16)13(12(5)21-17)19(25)26-10(2)3/h7,9-10,14H,6,8H2,1-5H3,(H2,21,22,23,24)InChIKey
PFVWURVKDRWDCD-UHFFFAOYSA-NSynonyms
878624-87-4878624874
CCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=C(C=CS3)C)C(=O)OC(C)C)C
CCCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1sccc1C)C(=O)OC(C)C)C
InChI=1SC20H25N3O3S2c1682820221715(18(24)2320)14(1611(4)792716)13(12(5)2117)19(25)2610(2)3h791014H68H215H3(H221222324)
MFCD08262243
propan2yl7methyl5(3methylthiophen2yl)4oxo2(propylsulfanyl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
propan2yl7methyl5(3methylthiophen2yl)4oxo2propylsulfanyl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000008346006
ZINC000008346007
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