Vitas-M small molecule compound
ethyl 2-(butylsulfanyl)-7-methyl-4-oxo-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980971
SMILES CCCCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1cccnc1)C(=O)OCC)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 C20H24N4O3S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O3S/c1-4-6-10-28-20-23-17-16(18(25)24-20)15(13-8-7-9-21-11-13)14(12(3)22-17)19(26)27-5-2/h7-9,11,15H,4-6,10H2,1-3H3,(H2,22,23,24,25)InChIKey
BUKYRDQQXOOKDD-UHFFFAOYSA-NSynonyms
CCCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CN=CC=C3)C(=O)OCC)C
CCCCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1cccnc1)C(=O)OCC)C
ethyl2(butylsulfanyl)7methyl4oxo5(pyridin3yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
ethyl2butylsulfanyl7methyl4oxo5pyridin3yl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
InChI=1SC20H24N4O3Sc146102820231716(18(25)2420)15(13879211113)14(12(3)2217)19(26)2752h791115H4610H213H3(H222232425)
MFCD08262264
ZINC000008346036
ZINC000008346037
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