Vitas-M small molecule compound
6-amino-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-5-phenylpyrimidin-4(1H)-one
Catalog ID
STL430304
SMILES O=C(N1CCc2c(C1)cccc2)CSc1nc(=O)c(c([nH]1)N)c1ccccc1
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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 C21H20N4O2S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S/c22-19-18(15-7-2-1-3-8-15)20(27)24-21(23-19)28-13-17(26)25-11-10-14-6-4-5-9-16(14)12-25/h1-9H,10-13H2,(H3,22,23,24,27)InChIKey
PIURIESIGBSEOO-UHFFFAOYSA-NSynonyms
6AMINO2((2(34DIHYDRO2(1H)ISOQUINOLINYL)2OXOETHYL)THIO)5PHENYL4(3H)PYRIMIDINONE
6amino2((2(34dihydroisoquinolin2(1H)yl)2oxoethyl)sulfanyl)5phenylpyrimidin4(1H)one
6AMINO2(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)SULFANYL5PHENYL1HPYRIMIDIN4ONE
C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC(=O)C(=C(N3)N)C4=CC=CC=C4
InChI=1SC21H20N4O2Sc221918(157213815)20(27)2421(2319)281317(26)25111014645916(14)1225h19H1013H2(H322232427)
MFCD30710958
O=C(N1CCc2c(C1)cccc2)CSc1nc(=O)c(c((nH)1)N)c1ccccc1
ZINC000018193089
ZINC18193089
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