Vitas-M small molecule compound
propan-2-yl 7-methyl-5-(4-methylphenyl)-4-oxo-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981077
SMILES CCCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1ccc(cc1)C)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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-6-11-29-22-24-19-18(20(26)25-22)17(15-9-7-13(4)8-10-15)16(14(5)23-19)21(27)28-12(2)3/h7-10,12,17H,6,11H2,1-5H3,(H2,23,24,25,26)InChIKey
IQNNVWPZKUHWHT-UHFFFAOYSA-NSynonyms
878122-72-6878122726
CCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CC=C(C=C3)C)C(=O)OC(C)C)C
CCCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1ccc(cc1)C)C(=O)OC(C)C)C
InChI=1SC22H27N3O3Sc16112922241918(20(26)2522)17(159713(4)81015)16(14(5)2319)21(27)2812(2)3h7101217H611H215H3(H223242526)
MFCD08256064
propan2yl7methyl5(4methylphenyl)4oxo2(propylsulfanyl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
propan2yl7methyl5(4methylphenyl)4oxo2propylsulfanyl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000007990938
ZINC000007990939
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