[4-(phenylmethyl)piperazin-1-yl]-[4-[(phenylmethyl)sulfonylmethyl]phenyl]methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-[4-[(phenylmethyl)sulfonylmethyl]phenyl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[4-(benzylsulfonylmethyl)phenyl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-[4-[(phenylmethyl)sulfonylmethyl]phenyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[4-(benzylsulfonylmethyl)phenyl]methanone Traditional Name: (4-benzylpiperazino)-[4-(benzylsulfonylmethyl)phenyl]methanone Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O3S/c29-26(28-17-15-27(16-18-28)19-22-7-3-1-4-8-22)25-13-11-24(12-14-25)21-32(30,31)20-23-9-5-2-6-10-23/h1-14H,15-21H2