N-[1-(1-adamantyl)ethyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-[4-(benzenesulfonyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxobutanamide Traditional Name: N-[1-(1-adamantyl)ethyl]-4-(4-besylpiperazino)-4-keto-butyramide Formula: C26H37N3O4S MolecularWeight: 487.65468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCC(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCC(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H37N3O4S/c1-19(26-16-20-13-21(17-26)15-22(14-20)18-26)27-24(30)7-8-25(31)28-9-11-29(12-10-28)34(32,33)23-5-3-2-4-6-23/h2-6,19-22H,7-18H2,1H3,(H,27,30)