Vitas-M small molecule compound
11-{[(E)-(4-tert-butylphenyl)methylidene]amino}-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL238412
SMILES C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1ccc(cc1)C(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 C26H24N6O MW 436.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N6O/c1-5-14-31-16-27-23-21(25(31)33)22-24(30-20-9-7-6-8-19(20)29-22)32(23)28-15-17-10-12-18(13-11-17)26(2,3)4/h5-13,15-16H,1,14H2,2-4H3/b28-15+InChIKey
GUAXBBIYTZLWIC-RWPZCVJISA-NSynonyms
861109-45-7(E)3allyl11((4(tertbutyl)benzylidene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4tertbutylphenyl)methylidene)amino)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861109457
C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccc(cc1)C(C)(C)C
CC(C)(C)C1=CC=C(C=C1)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC=C
InChI=1SC26H24N6Oc15143116272321(25(31)33)2224(3020976819(20)2922)32(23)281517101218(131117)26(23)4h5131516H114H224H3b2815+
MFCD04179850
ZINC000002211055
ZINC2211054
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