N-[1-(1-adamantyl)ethyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[1-(1-adamantyl)ethyl]butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[1-(1-adamantyl)ethyl]butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[1-(1-adamantyl)ethyl]butanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[1-(1-adamantyl)ethyl]butyramide Formula: C25H36N2O4S MolecularWeight: 460.62934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCCN(C)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCCN(C)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C25H36N2O4S/c1-17(28)22-6-8-23(9-7-22)32(30,31)27(3)10-4-5-24(29)26-18(2)25-14-19-11-20(15-25)13-21(12-19)16-25/h6-9,18-21H,4-5,10-16H2,1-3H3,(H,26,29)