Vitas-M small molecule compound
3-(2-phenylethyl)-11-{[(E)-pyridin-4-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK555816
SMILES O=c1n(CCc2ccccc2)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 C26H19N7O MW 445.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N7O/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/h1-11,13-14,16-17H,12,15H2/b29-16+InChIKey
FWBIMVDJFVOWRE-MUFRIFMGSA-NSynonyms
861820-71-5(E)3phenethyl11((pyridin4ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2phenylethyl)11(((E)pyridin4ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861820715
C1=CC=C(C=C1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=NC=C6
InChI=1SC26H19N7Oc3426222325(3121954820(21)3023)33(291619101327141119)24(22)281732(26)1512186213718h11113141617H1215H2b2916+
MFCD04013834
O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2N=Cc1ccncc1
ZINC000002234380
ZINC33351241
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