Vitas-M small molecule compound
3-(prop-2-en-1-yl)-11-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL237634
SMILES C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cc(OC)c(c(c1)OC)OC
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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 C25H22N6O4 MW 470.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N6O4/c1-5-10-30-14-26-23-20(25(30)32)21-24(29-17-9-7-6-8-16(17)28-21)31(23)27-13-15-11-18(33-2)22(35-4)19(12-15)34-3/h5-9,11-14H,1,10H2,2-4H3/b27-13+InChIKey
PHFMLTDKCKVKPG-UVHMKAGCSA-NSynonyms
861109-52-6(E)3allyl11((345trimethoxybenzylidene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(prop2en1yl)11(((E)(345trimethoxyphenyl)methylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861109526
C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cc(OC)c(c(c1)OC)OC
COC1=CC(=CC(=C1OC)OC)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC=C
InChI=1SC25H22N6O4c15103014262320(25(30)32)2124(2917976816(17)2821)31(23)2713151118(332)22(354)19(1215)343h591114H110H224H3b2713+
MFCD04182577
ZINC000002345636
ZINC32311438
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