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

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-[(4-chlorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-(4-chloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-(4-chloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(4-chloro-N-methylsulfonylanilino)butanamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-(4-chloro-N-mesyl-anilino)butyramide Formula: C27H33ClN2O3S MolecularWeight: 501.08052

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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=C(C=C5)Cl)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C27H33ClN2O3S/c1-3-25(30(34(2,32)33)24-10-6-22(28)7-11-24)26(31)29-23-8-4-21(5-9-23)27-15-18-12-19(16-27)14-20(13-18)17-27/h4-11,18-20,25H,3,12-17H2,1-2H3,(H,29,31)