Vitas-M small molecule compound
1-benzyl-4,5-diphenyl-2-{[(E)-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methylidene]amino}-1H-pyrrole-3-carbonitrile
Catalog ID
STK034952
SMILES N#Cc1c(/N=C/N2CC3(CC2CC(C3)(C)C)C)n(c(c1c1ccccc1)c1ccccc1)Cc1ccccc1
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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 C35H36N4 MW 512.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N4/c1-34(2)19-29-20-35(3,23-34)24-38(29)25-37-33-30(21-36)31(27-15-9-5-10-16-27)32(28-17-11-6-12-18-28)39(33)22-26-13-7-4-8-14-26/h4-18,25,29H,19-20,22-24H2,1-3H3/b37-25+InChIKey
CZEUCIADRZQFIZ-AUGOTPMTSA-NSynonyms
627053-51-4(E)1benzyl45diphenyl2(((133trimethyl6azabicyclo(321)octan6yl)methylene)amino)1Hpyrrole3carbonitrile
1BENZYL45DIPHENYL2(((E)(133TRIMETHYL6AZABICYCLO(321)OCT6YL)METHYLIDENE)AMINO)1HPYRROLE3CARBONITRILE
1benzyl45diphenyl2((E)(335trimethyl7azabicyclo(321)octan7yl)methylideneamino)pyrrole3carbonitrile
627053514
CC1(CC2CC(C1)(CN2C=NC3=C(C(=C(N3CC4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C#N)C)C
InChI=1SC35H36N4c134(2)19292035(32334)2438(29)25373330(2136)31(271595101627)32(2817116121828)39(33)2226137481426h4182529H19202224H213H3b3725+
MFCD03679382
N#Cc1c(N=CN2CC3(CC2CC(C3)(C)C)C)n(c(c1c1ccccc1)c1ccccc1)Cc1ccccc1
STK034952
ZINC000100980925
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