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4,4'-[methanediylbis(2,4,6-trimethylbenzene-3,1-diyl)]bis(2-amino-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile)

Catalog ID
STK367217
SMILES N#CC1=C(N)OC2=C(C1c1c(C)cc(c(c1C)Cc1c(C)cc(c(c1C)C1C(=C(N)OC3=C1C(=O)CC(C3)(C)C)C#N)C)C)C(=O)CC(C2)(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 C43H48N4O4 MW 684.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H48N4O4/c1-20-11-22(3)34(36-28(18-44)40(46)50-32-16-42(7,8)14-30(48)38(32)36)24(5)26(20)13-27-21(2)12-23(4)35(25(27)6)37-29(19-45)41(47)51-33-17-43(9,10)15-31(49)39(33)37/h11-12,36-37H,13-17,46-47H2,1-10H3
InChIKey
OHXXXMUZDDXCOC-UHFFFAOYSA-N
Synonyms

2AMINO4(3((3(2AMINO3CYANO77DIMETHYL5OXO(4H678TRIHYDROCHROMEN4YL))246TRIMETHYLPHENYL)METHYL)246TRIMETHYLPHENYL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2AMINO4(3((3(2AMINO3CYANO77DIMETHYL5OXO68DIHYDRO4HCHROMEN4YL)246TRIMETHYLPHENYL)METHYL)246TRIMETHYLPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
44(methanediylbis(246trimethylbenzene31diyl))bis(2amino77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile)
CC1=CC(=C(C(=C1C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)C)CC4=C(C=C(C(=C4C)C5C(=C(OC6=C5C(=O)CC(C6)(C)C)N)C#N)C)C)C
InChI=1SC43H48N4O4c1201122(3)34(3628(1844)40(46)50321642(78)1430(48)38(32)36)24(5)26(20)132721(2)1223(4)35(25(27)6)3729(1945)41(47)51331743(910)1531(49)39(33)37h11123637H13174647H2110H3
MFCD00308816
ZINC000004015963
ZINC000150408046

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Available files

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