Vitas-M small molecule compound
3-(butan-2-yl)-11-[2-(3,4-dimethoxyphenyl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714333
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)C(CC)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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-5-16(2)31-15-27-24-22(26(31)32)23-25(29-19-9-7-6-8-18(19)28-23)30(24)13-12-17-10-11-20(33-3)21(14-17)34-4/h6-11,14-16H,5,12-13H2,1-4H3InChIKey
AIMFHTAUDLNUMJ-UHFFFAOYSA-NSynonyms
844457-56-33(butan2yl)11(2(34dimethoxyphenyl)ethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11(34dimethoxyphenethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844457563
CCC(C)N1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC
InChI=1SC26H27N5O3c1516(2)3115272422(26(31)32)2325(2919976818(19)2823)30(24)131217101120(333)21(1417)344h6111416H51213H214H3
MFCD04155501
ZINC000002400790
ZINC000002400791
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