Vitas-M small molecule compound
1-(3-methylphenyl)-6-(1-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK574460
SMILES Cc1cccc(c1)n1c(S)nc(=O)c2c1NCN(C2)C(c1ccccc1)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 C21H22N4OS MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS/c1-14-7-6-10-17(11-14)25-19-18(20(26)23-21(25)27)12-24(13-22-19)15(2)16-8-4-3-5-9-16/h3-11,15,22H,12-13H2,1-2H3,(H,23,26,27)InChIKey
SWPBHYHIRYDOPO-UHFFFAOYSA-NSynonyms
879596-04-01(3methylphenyl)6(1phenylethyl)2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
1(3methylphenyl)6(1phenylethyl)2sulfanylidene78dihydro5Hpyrimido(45d)pyrimidin4one
879596040
CC1=CC(=CC=C1)N2C3=C(CN(CN3)C(C)C4=CC=CC=C4)C(=O)NC2=S
InChI=1SC21H22N4OSc114761017(1114)251918(20(26)2321(25)27)1224(132219)15(2)168435916h3111522H1213H212H3(H232627)
MFCD07797680
ZINC000020417657
ZINC000020417659
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