Vitas-M small molecule compound
11-[4-(butan-2-yl)phenyl]-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL056847
SMILES CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)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 C29H33N5O MW 467.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O/c1-4-6-7-8-11-18-33-19-30-27-25(29(33)35)26-28(32-24-13-10-9-12-23(24)31-26)34(27)22-16-14-21(15-17-22)20(3)5-2/h9-10,12-17,19-20H,4-8,11,18H2,1-3H3InChIKey
IJUIBFCUAGBKBE-UHFFFAOYSA-NSynonyms
844851-54-311(4(butan2yl)phenyl)3heptyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4(secbutyl)phenyl)3heptyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844851543
CCCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)C(C)CC
InChI=1SC29H33N5Oc1467811183319302725(29(33)35)2628(3224131091223(24)3126)34(27)22161421(151722)20(3)52h91012171920H481118H213H3
MFCD04164377
ZINC000002410954
ZINC000002410955
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