Vitas-M small molecule compound
3-[2-(cyclohex-1-en-1-yl)ethyl]-11-{[(E)-pyridin-4-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK591879
SMILES O=c1n(CCC2=CCCCC2)cnc2c1c1nc3ccccc3nc1n2/N=C/c1ccncc1
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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(31-21-9-5-4-8-20(21)30-23)33(29-16-19-10-13-27-14-11-19)24(22)28-17-32(26)15-12-18-6-2-1-3-7-18/h4-6,8-11,13-14,16-17H,1-3,7,12,15H2/b29-16+InChIKey
MEVPJYJKAQYTKZ-MUFRIFMGSA-NSynonyms
850825-05-7(E)3(2(cyclohex1en1yl)ethyl)11((pyridin4ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2(cyclohex1en1yl)ethyl)11(((E)pyridin4ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
850825057
C1CCC(=CC1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=NC=C6
InChI=1SC26H23N7Oc3426222325(3121954820(21)3023)33(291619101327141119)24(22)281732(26)1512186213718h4681113141617H1371215H2b2916+
MFCD05694115
O=c1n(CCC2=CCCCC2)cnc2c1c1nc3ccccc3nc1n2N=Cc1ccncc1
ZINC000002416002
ZINC33367551
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