2-phenyl-1-[4-(phenylsulfonyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 2-phenyl-1-[4-(phenylsulfonyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-phenyl-pentan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-phenyl-1-pentanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-phenylpentan-1-one Traditional Name: 1-(4-besylpiperazino)-2-phenyl-pentan-1-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S/c1-2-9-20(18-10-5-3-6-11-18)21(24)22-14-16-23(17-15-22)27(25,26)19-12-7-4-8-13-19/h3-8,10-13,20H,2,9,14-17H2,1H3