N-(4-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyridazin-3-amine

Systemtic Name: N-(4-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]pyridazin-3-amine Openeye Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-N-(p-tolyl)pyridazin-3-amine CAS Name: 6-[4-(benzenesulfonyl)-1-piperazinyl]-N-(4-methylphenyl)-3-pyridazinamine IUPAC Name: 6-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-methylphenyl)pyridazin-3-amine Traditional Name: [6-(4-besylpiperazino)pyridazin-3-yl]-(p-tolyl)amine Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2S/c1-17-7-9-18(10-8-17)22-20-11-12-21(24-23-20)25-13-15-26(16-14-25)29(27,28)19-5-3-2-4-6-19/h2-12H,13-16H2,1H3,(H,22,23)