N-(1-adamantyl)-2-(4-methylphenyl)sulfonyl-3-phenyl-3H-isoindol-1-imine

Systemtic Name: N-(1-adamantyl)-2-(4-methylphenyl)sulfonyl-3-phenyl-3H-isoindol-1-imine Openeye Name: N-(1-adamantyl)-3-phenyl-2-(p-tolylsulfonyl)isoindolin-1-imine CAS Name: N-(1-adamantyl)-2-(4-methylphenyl)sulfonyl-3-phenyl-3H-isoindol-1-imine IUPAC Name: N-(1-adamantyl)-2-(4-methylphenyl)sulfonyl-3-phenyl-3H-isoindol-1-imine Traditional Name: 1-adamantyl-(3-phenyl-2-tosyl-isoindolin-1-ylidene)amine Formula: C31H32N2O2S MolecularWeight: 496.66298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C3=CC=CC=C3C2=NC45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C3=CC=CC=C3C2=NC45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C31H32N2O2S/c1-21-11-13-26(14-12-21)36(34,35)33-29(25-7-3-2-4-8-25)27-9-5-6-10-28(27)30(33)32-31-18-22-15-23(19-31)17-24(16-22)20-31/h2-14,22-24,29H,15-20H2,1H3