Vitas-M small molecule compound
2-(5,7-diphenyl-1,2,3,4,4a,5-hexahydro-10H-benzimidazo[2,1-j]quinolin-10-ylidene)-1,3-diphenylpropane-1,3-dione
Catalog ID
STK535551
SMILES O=C(/C(=c\1/ccc2=NC34N(c2c1)C(=CC(C4CCCC3)c1ccccc1)c1ccccc1)/C(=O)c1ccccc1)c1ccccc1
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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 C42H34N2O2 MW 598.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H34N2O2/c45-40(31-19-9-3-10-20-31)39(41(46)32-21-11-4-12-22-32)33-24-25-36-38(27-33)44-37(30-17-7-2-8-18-30)28-34(29-15-5-1-6-16-29)35-23-13-14-26-42(35,44)43-36/h1-12,15-22,24-25,27-28,34-35H,13-14,23,26H2InChIKey
WSCAEWNQAUQUOU-UHFFFAOYSA-NSynonyms
2(57diphenyl12344a5hexahydro10Hbenzimidazo(21j)quinolin10ylidene)13diphenylpropane13dione
2(57diphenyl344a5tetrahydro1Hbenzo(45)imidazo(21j)quinolin10(2H)ylidene)13diphenylpropane13dione
C1CCC23C(C1)C(C=C(N2C4=CC(=C(C(=O)C5=CC=CC=C5)C(=O)C6=CC=CC=C6)C=CC4=N3)C7=CC=CC=C7)C8=CC=CC=C8
InChI=1SC42H34N2O2c4540(311993102031)39(41(46)3221114122232)3324253638(2733)4437(30177281830)2834(29155161629)352313142642(3544)4336h1121522242527283435H13142326H2
MFCD01088109
O=C(C(=c1ccc2=NC34N(c2c1)C(=CC(C4CCCC3)c1ccccc1)c1ccccc1)C(=O)c1ccccc1)c1ccccc1
ZINC000102416527
ZINC000105789801
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