Vitas-M small molecule compound
3-{1-[2-(benzylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-(4-fluorophenyl)propanamide
Catalog ID
STK605352
SMILES O=C(Nc1ccc(cc1)F)CCn1c(=O)n(CC(=O)NCc2ccccc2)c2c(c1=O)scc2
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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 C24H21FN4O4S MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN4O4S/c25-17-6-8-18(9-7-17)27-20(30)10-12-28-23(32)22-19(11-13-34-22)29(24(28)33)15-21(31)26-14-16-4-2-1-3-5-16/h1-9,11,13H,10,12,14-15H2,(H,26,31)(H,27,30)InChIKey
LGXUGHNDOLMPFE-UHFFFAOYSA-NSynonyms
903186-29-83(1(2(benzylamino)2oxoethyl)24dioxo12dihydrothieno(32d)pyrimidin3(4H)yl)N(4fluorophenyl)propanamide
3(1(2(benzylamino)2oxoethyl)24dioxo14dihydrothieno(32d)pyrimidin3(2H)yl)N(4fluorophenyl)propanamide
3(1(2(benzylamino)2oxoethyl)24dioxothieno(32d)pyrimidin3yl)N(4fluorophenyl)propanamide
903186298
C1=CC=C(C=C1)CNC(=O)CN2C3=C(C(=O)N(C2=O)CCC(=O)NC4=CC=C(C=C4)F)SC=C3
InChI=1SC24H21FN4O4Sc25176818(9717)2720(30)10122823(32)2219(11133422)29(24(28)33)1521(31)2614164213516h191113H10121415H2(H2631)(H2730)
MFCD08286805
ZINC000009409527
ZINC09409527
ZINC9409527
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