1-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-[(4-phenylphenyl)methyl]-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]sulfonylazepane Traditional Name: 1-[4-(4-phenylbenzyl)piperazino]sulfonylazepane Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H31N3O2S/c27-29(28,25-14-6-1-2-7-15-25)26-18-16-24(17-19-26)20-21-10-12-23(13-11-21)22-8-4-3-5-9-22/h3-5,8-13H,1-2,6-7,14-20H2