Vitas-M small molecule compound
3-[2-(cyclohex-1-en-1-yl)ethyl]-11-{[(E)-pyridin-3-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK643985
SMILES O=c1n(CCC2=CCCCC2)cnc2c1c1nc3ccccc3nc1n2/N=C/c1cccnc1
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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 C26H23N7O MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N7O/c34-26-22-23-25(31-21-11-5-4-10-20(21)30-23)33(29-16-19-9-6-13-27-15-19)24(22)28-17-32(26)14-12-18-7-2-1-3-8-18/h4-7,9-11,13,15-17H,1-3,8,12,14H2/b29-16+InChIKey
SQXBNYSZHTXOAZ-MUFRIFMGSA-NSynonyms
860792-91-2(E)3(2(cyclohex1en1yl)ethyl)11((pyridin3ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2(cyclohex1en1yl)ethyl)11(((E)pyridin3ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860792912
C1CCC(=CC1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CN=CC=C6
InChI=1SC26H23N7Oc3426222325(312111541020(21)3023)33(2916199613271519)24(22)281732(26)1412187213818h47911131517H1381214H2b2916+
MFCD04162976
O=c1n(CCC2=CCCCC2)cnc2c1c1nc3ccccc3nc1n2N=Cc1cccnc1
ZINC000002409630
ZINC33365840
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