5-[4-(phenylmethyl)piperazin-1-yl]-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 5-[4-(phenylmethyl)piperazin-1-yl]-3-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-(benzenesulfonyl)-5-(4-benzylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-(benzenesulfonyl)-5-[4-(phenylmethyl)-1-piperazinyl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-(benzenesulfonyl)-5-(4-benzylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine Traditional Name: 5-(4-benzylpiperazino)-3-besyl-1H-pyrrolo[2,3-b]pyridine Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CN=C4C(=C3)C(=CN4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CN=C4C(=C3)C(=CN4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H24N4O2S/c29-31(30,21-9-5-2-6-10-21)23-17-26-24-22(23)15-20(16-25-24)28-13-11-27(12-14-28)18-19-7-3-1-4-8-19/h1-10,15-17H,11-14,18H2,(H,25,26)