Vitas-M small molecule compound
11-{[(E)-(4-tert-butylphenyl)methylidene]amino}-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL241042
SMILES COCCn1cnc2c(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 C26H26N6O2 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N6O2/c1-26(2,3)18-11-9-17(10-12-18)15-28-32-23-21(25(33)31(16-27-23)13-14-34-4)22-24(32)30-20-8-6-5-7-19(20)29-22/h5-12,15-16H,13-14H2,1-4H3/b28-15+InChIKey
SDQPALBFMHCFPH-RWPZCVJISA-NSynonyms
860806-58-2(E)11((4(tertbutyl)benzylidene)amino)3(2methoxyethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4tertbutylphenyl)methylidene)amino)3(2methoxyethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860806582
CC(C)(C)C1=CC=C(C=C1)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CCOC
COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccc(cc1)C(C)(C)C
InChI=1SC26H26N6O2c126(23)1811917(101218)1528322321(25(33)31(162723)1314344)2224(32)3020865719(20)2922h5121516H1314H214H3b2815+
MFCD04169844
ZINC000002417435
ZINC2417434
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