Vitas-M small molecule compound

1,3-diphenyl-2-(1,3,4a-triphenyl-4,4a-dihydropyrido[1,2-a]benzimidazol-8(3H)-ylidene)propane-1,3-dione

Catalog ID
STK537613
SMILES O=C(/C(=c\1/ccc2=NC3(N(c2c1)C(=CC(C3)c1ccccc1)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 C44H32N2O2 MW 620.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C44H32N2O2/c47-42(33-20-10-3-11-21-33)41(43(48)34-22-12-4-13-23-34)35-26-27-38-40(28-35)46-39(32-18-8-2-9-19-32)29-36(31-16-6-1-7-17-31)30-44(46,45-38)37-24-14-5-15-25-37/h1-29,36H,30H2
InChIKey
PNCMMDSNMFZKCS-UHFFFAOYSA-N
Synonyms

13diphenyl2(134atriphenyl44adihydrobenzo(45)imidazo(12a)pyridin8(3H)ylidene)propane13dione
13diphenyl2(134atriphenyl44adihydropyrido(12a)benzimidazol8(3H)ylidene)propane13dione
2(134ATRIPHENYL34DIHYDROPYRIDO(12A)BENZIMIDAZOL8YLIDENE)13DIPHENYLPROPANE13DIONE
C1C(C=C(N2C1(N=C3C2=CC(=C(C(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)C=C3)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8
InChI=1SC44H32N2O2c4742(3320103112133)41(43(48)3422124132334)3526273840(2835)4639(32188291932)2936(31166171731)3044(464538)3724145152537h12936H30H2
MFCD01875004
O=C(C(=c1ccc2=NC3(N(c2c1)C(=CC(C3)c1ccccc1)c1ccccc1)c1ccccc1)C(=O)c1ccccc1)c1ccccc1
ZINC000102421145
ZINC000102421155

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Available files

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