N-[4-(1-adamantyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-[N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-(N-tosylanilino)acetamide Formula: C31H34N2O3S MolecularWeight: 514.67826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6

InChI

InChI=1S/C31H34N2O3S/c1-22-7-13-29(14-8-22)37(35,36)33(28-5-3-2-4-6-28)21-30(34)32-27-11-9-26(10-12-27)31-18-23-15-24(19-31)17-25(16-23)20-31/h2-14,23-25H,15-21H2,1H3,(H,32,34)