4-[4-(phenylmethyl)piperazin-1-yl]-1-(phenylsulfonyl)indole

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-4-(4-benzylpiperazin-1-yl)indole CAS Name: 1-(benzenesulfonyl)-4-[4-(phenylmethyl)-1-piperazinyl]indole IUPAC Name: 1-(benzenesulfonyl)-4-(4-benzylpiperazin-1-yl)indole Traditional Name: 4-(4-benzylpiperazino)-1-besyl-indole Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H25N3O2S/c29-31(30,22-10-5-2-6-11-22)28-15-14-23-24(12-7-13-25(23)28)27-18-16-26(17-19-27)20-21-8-3-1-4-9-21/h1-15H,16-20H2