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

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-[methyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-[methyl(tosyl)amino]acetamide Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O3S/c1-18-3-9-24(10-4-18)32(30,31)28(2)17-25(29)27-23-7-5-22(6-8-23)26-14-19-11-20(15-26)13-21(12-19)16-26/h3-10,19-21H,11-17H2,1-2H3,(H,27,29)