Vitas-M small molecule compound
2-(butan-2-ylsulfanyl)-8,8-dimethyl-5-phenyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918773
SMILES CCC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccccc1)C(=O)CC(C3)(C)C)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 C23H27N3O2S MW 409.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O2S/c1-5-13(2)29-22-25-20-19(21(28)26-22)17(14-9-7-6-8-10-14)18-15(24-20)11-23(3,4)12-16(18)27/h6-10,13,17H,5,11-12H2,1-4H3,(H2,24,25,26,28)InChIKey
NMTAUSHAMAUDCS-UHFFFAOYSA-NSynonyms
2(butan2ylsulfanyl)88dimethyl5phenyl58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2butan2ylsulfanyl88dimethyl5phenyl57910tetrahydro1Hpyrimido(45b)quinoline46dione
CCC(C)SC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4)C(=O)CC(C3)(C)C
CCC(Sc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccccc1)C(=O)CC(C3)(C)C)C
InChI=1SC23H27N3O2Sc1513(2)2922252019(21(28)2622)17(1497681014)1815(2420)1123(34)1216(18)27h6101317H51112H214H3(H224252628)
MFCD06316310
ZINC000016807404
ZINC000016807409
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