Vitas-M small molecule compound
11-{[(E)-(4-tert-butylphenyl)methylidene]amino}-3-hexyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK644722
SMILES CCCCCCn1c(C)nc2c(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 C30H34N6O MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N6O/c1-6-7-8-11-18-35-20(2)32-27-25(29(35)37)26-28(34-24-13-10-9-12-23(24)33-26)36(27)31-19-21-14-16-22(17-15-21)30(3,4)5/h9-10,12-17,19H,6-8,11,18H2,1-5H3/b31-19+InChIKey
PZQLOEHGAZGXQO-ZCTHSVRISA-NSynonyms
877781-34-5(E)11((4(tertbutyl)benzylidene)amino)3hexyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4tertbutylphenyl)methylidene)amino)3hexyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
877781345
CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC=C(C=C5)C(C)(C)C)C
CCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccc(cc1)C(C)(C)C
InChI=1SC30H34N6Oc167811183520(2)322725(29(35)37)2628(3424131091223(24)3326)36(27)311921141622(171521)30(34)5h910121719H681118H215H3b3119+
MFCD05700445
ZINC000009345054
ZINC33904905
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