Vitas-M small molecule compound
3-(butan-2-yl)-2-methyl-11-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL345234
SMILES CCC(n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2CC1CCCO1)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 C22H25N5O2 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O2/c1-4-13(2)27-14(3)23-20-18(22(27)28)19-21(26(20)12-15-8-7-11-29-15)25-17-10-6-5-9-16(17)24-19/h5-6,9-10,13,15H,4,7-8,11-12H2,1-3H3InChIKey
UTDOORRCCBEOCH-UHFFFAOYSA-NSynonyms
847859-84-13(butan2yl)2methyl11(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)2methyl11((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
847859841
CCC(C)N1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5CCCO5)C
InChI=1SC22H25N5O2c1413(2)2714(3)232018(22(27)28)1921(26(20)121587112915)25171065916(17)2419h569101315H4781112H213H3
MFCD04185911
ZINC000002414472
ZINC000002414475
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