N-(1-adamantyl)-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(1-adamantyl)-2-(3,4-dimethyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-(1-adamantyl)-2-(3,4-dimethyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(1-adamantyl)-2-(3,4-dimethyl-N-methylsulfonylanilino)butanamide Traditional Name: N-(1-adamantyl)-2-(N-mesyl-3,4-dimethyl-anilino)butyramide Formula: C23H34N2O3S MolecularWeight: 418.59266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC12CC3CC(C1)CC(C3)C2)N(C4=CC(=C(C=C4)C)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC12CC3CC(C1)CC(C3)C2)N(C4=CC(=C(C=C4)C)C)S(=O)(=O)C

InChI

InChI=1S/C23H34N2O3S/c1-5-21(25(29(4,27)28)20-7-6-15(2)16(3)8-20)22(26)24-23-12-17-9-18(13-23)11-19(10-17)14-23/h6-8,17-19,21H,5,9-14H2,1-4H3,(H,24,26)