Vitas-M small molecule compound
N-benzyl-2-{4-[4-(methylsulfanyl)phenyl]-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl}acetamide
Catalog ID
STL142477
SMILES CSc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)OC2)CC(=O)NCc1ccccc1
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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 C22H21N3O4S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S/c1-30-16-9-7-15(8-10-16)20-19-17(13-29-21(19)27)25(22(28)24-20)12-18(26)23-11-14-5-3-2-4-6-14/h2-10,20H,11-13H2,1H3,(H,23,26)(H,24,28)InChIKey
PDGMHUKWAXPGHR-UHFFFAOYSA-NSynonyms
CSC1=CC=C(C=C1)C2C3=C(COC3=O)N(C(=O)N2)CC(=O)NCC4=CC=CC=C4
InChI=1SC22H21N3O4Sc130169715(81016)201917(132921(19)27)25(22(28)2420)1218(26)2311145324614h21020H1113H21H3(H2326)(H2428)
MFCD20742100
Nbenzyl2(4(4(methylsulfanyl)phenyl)25dioxo3457tetrahydrofuro(34d)pyrimidin1(2H)yl)acetamide
Nbenzyl2(4(4methylsulfanylphenyl)25dioxo47dihydro3Hfuro(34d)pyrimidin1yl)acetamide
ZINC000071326778
ZINC000071326779
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