Vitas-M small molecule compound
4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)benzonitrile
Catalog ID
STK756168
SMILES N#Cc1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
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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 C26H22N2O MW 378.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O/c1-26(2)13-20-23-19-6-4-3-5-17(19)11-12-21(23)28-25(24(20)22(29)14-26)18-9-7-16(15-27)8-10-18/h3-12,25,28H,13-14H2,1-2H3InChIKey
WXBXSFSCEIBENK-UHFFFAOYSA-NSynonyms
4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)benzonitrile
4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)benzonitrile
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)C#N)C(=O)C1)C
InChI=1SC26H22N2Oc126(2)13202319643517(19)111221(23)2825(24(20)22(29)1426)189716(1527)81018h3122528H1314H212H3
MFCD01029789
ZINC000000832964
ZINC000000832965
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