Vitas-M small molecule compound
N-[3-(methylsulfanyl)phenyl]-2-{4-[4-(methylsulfanyl)phenyl]-2,5-dioxo-3,4,5,7-tetrahydrofuro[3,4-d]pyrimidin-1(2H)-yl}acetamide
Catalog ID
STL128505
SMILES CSc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)OC2)CC(=O)Nc1cccc(c1)SC
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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 C22H21N3O4S2 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S2/c1-30-15-8-6-13(7-9-15)20-19-17(12-29-21(19)27)25(22(28)24-20)11-18(26)23-14-4-3-5-16(10-14)31-2/h3-10,20H,11-12H2,1-2H3,(H,23,26)(H,24,28)InChIKey
BPFFOBJTYFSLGP-UHFFFAOYSA-NSynonyms
CSC1=CC=C(C=C1)C2C3=C(COC3=O)N(C(=O)N2)CC(=O)NC4=CC(=CC=C4)SC
InChI=1SC22H21N3O4S2c130158613(7915)201917(122921(19)27)25(22(28)2420)1118(26)231443516(1014)312h31020H1112H212H3(H2326)(H2428)
MFCD20742143
N(3(methylsulfanyl)phenyl)2(4(4(methylsulfanyl)phenyl)25dioxo3457tetrahydrofuro(34d)pyrimidin1(2H)yl)acetamide
N(3methylsulfanylphenyl)2(4(4methylsulfanylphenyl)25dioxo47dihydro3Hfuro(34d)pyrimidin1yl)acetamide
ZINC000067288948
ZINC000067288951
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