3-[4-(phenylmethyl)piperazin-1-yl]-6-(phenylsulfonyl)pyridazine

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]-6-(phenylsulfonyl)pyridazine Openeye Name: 3-(benzenesulfonyl)-6-(4-benzylpiperazin-1-yl)pyridazine CAS Name: 3-(benzenesulfonyl)-6-[4-(phenylmethyl)-1-piperazinyl]pyridazine IUPAC Name: 3-(benzenesulfonyl)-6-(4-benzylpiperazin-1-yl)pyridazine Traditional Name: 3-(4-benzylpiperazino)-6-besyl-pyridazine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NN=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NN=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c26-28(27,19-9-5-2-6-10-19)21-12-11-20(22-23-21)25-15-13-24(14-16-25)17-18-7-3-1-4-8-18/h1-12H,13-17H2