Vitas-M small molecule compound
1-hydroxy-4-methyl-9-(thiophen-2-yl)-9,10-dihydropyrimido[4,5-c]isoquinoline-3,7(4H,8H)-dione
Catalog ID
STK656003
SMILES O=C1CC(Cc2c1cnc1c2c(O)nc(=O)n1C)c1cccs1
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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 C16H13N3O3S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S/c1-19-14-13(15(21)18-16(19)22)9-5-8(12-3-2-4-23-12)6-11(20)10(9)7-17-14/h2-4,7-8H,5-6H2,1H3,(H,18,21,22)InChIKey
ZZZVNEGFVBKHSR-UHFFFAOYSA-NSynonyms
1030450-60-21030450602
1hydroxy4methyl9(thiophen2yl)910dihydropyrimido(45c)isoquinoline37(4H8H)dione
4methyl9thiophen2yl910dihydro8Hpyrimido(45c)isoquinoline137trione
CN1C2=NC=C3C(=C2C(=O)NC1=O)CC(CC3=O)C4=CC=CS4
InChI=1SC16H13N3O3Sc1191413(15(21)1816(19)22)958(123242312)611(20)10(9)71714h2478H56H21H3(H182122)
MFCD18167544
ZINC000019962266
ZINC000019962267
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