N-[4-(1-adamantyl)phenyl]-2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-(3-chloro-4-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-(3-chloro-4-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(3-chloro-4-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-(3-chloro-N-mesyl-4-methyl-anilino)acetamide Formula: C26H31ClN2O3S MolecularWeight: 487.05394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31ClN2O3S/c1-17-3-8-23(12-24(17)27)29(33(2,31)32)16-25(30)28-22-6-4-21(5-7-22)26-13-18-9-19(14-26)11-20(10-18)15-26/h3-8,12,18-20H,9-11,13-16H2,1-2H3,(H,28,30)