Vitas-M small molecule compound
propan-2-yl 7-methyl-2-[(2-methylpropyl)sulfanyl]-4-oxo-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980977
SMILES CC(CSc1nc2NC(=C(C(c2c(=O)[nH]1)c1cccnc1)C(=O)OC(C)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 C21H26N4O3S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O3S/c1-11(2)10-29-21-24-18-17(19(26)25-21)16(14-7-6-8-22-9-14)15(13(5)23-18)20(27)28-12(3)4/h6-9,11-12,16H,10H2,1-5H3,(H2,23,24,25,26)InChIKey
ZPOKRRHJMWCRBC-UHFFFAOYSA-NSynonyms
878123-31-0878123310
CC(CSc1nc2NC(=C(C(c2c(=O)(nH)1)c1cccnc1)C(=O)OC(C)C)C)C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CN=CC=C3)C(=O)OC(C)C
InChI=1SC21H26N4O3Sc111(2)102921241817(19(26)2521)16(1476822914)15(13(5)2318)20(27)2812(3)4h69111216H10H215H3(H223242526)
MFCD08256082
propan2yl7methyl2((2methylpropyl)sulfanyl)4oxo5(pyridin3yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
propan2yl7methyl2(2methylpropylsulfanyl)4oxo5pyridin3yl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000007990974
ZINC000007990975
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