N-[4-(1-adamantyl)phenyl]-2-[methylsulfonyl(phenyl)amino]butanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[methylsulfonyl(phenyl)amino]butanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-(N-methylsulfonylanilino)butanamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-(N-methylsulfonylanilino)butanamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(N-methylsulfonylanilino)butanamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-(N-mesylanilino)butyramide Formula: C27H34N2O3S MolecularWeight: 466.63546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)N(C5=CC=CC=C5)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)N(C5=CC=CC=C5)S(=O)(=O)C

InChI

InChI=1S/C27H34N2O3S/c1-3-25(29(33(2,31)32)24-7-5-4-6-8-24)26(30)28-23-11-9-22(10-12-23)27-16-19-13-20(17-27)15-21(14-19)18-27/h4-12,19-21,25H,3,13-18H2,1-2H3,(H,28,30)