Vitas-M small molecule compound
2-(butylsulfanyl)-5-(5-methylfuran-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980689
SMILES CCCCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(o1)C)C(=O)CCC3
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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 C20H23N3O3S MW 385.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O3S/c1-3-4-10-27-20-22-18-17(19(25)23-20)16(14-9-8-11(2)26-14)15-12(21-18)6-5-7-13(15)24/h8-9,16H,3-7,10H2,1-2H3,(H2,21,22,23,25)InChIKey
LXTAWSHQLVFYPU-UHFFFAOYSA-NSynonyms
628278-59-12(butylsulfanyl)5(5methylfuran2yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2butylsulfanyl5(5methylfuran2yl)1578910hexahydropyrimido(45b)quinoline46dione
628278591
CCCCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=C(O4)C)C(=O)CCC3
CCCCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccc(o1)C)C(=O)CCC3
InChI=1SC20H23N3O3Sc134102720221817(19(25)2320)16(149811(2)2614)1512(2118)65713(15)24h8916H3710H212H3(H221222325)
MFCD05717439
ZINC000005868793
ZINC000005868856
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