6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]-N-phenyl-pyridazin-3-amine

Systemtic Name: 6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]-N-phenyl-pyridazin-3-amine Openeye Name: 6-[4-(m-tolylsulfonyl)piperazin-1-yl]-N-phenyl-pyridazin-3-amine CAS Name: 6-[4-(3-methylphenyl)sulfonyl-1-piperazinyl]-N-phenyl-3-pyridazinamine IUPAC Name: 6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]-N-phenylpyridazin-3-amine Traditional Name: [6-[4-(m-tolylsulfonyl)piperazino]pyridazin-3-yl]-phenyl-amine Formula: C21H23N5O2S MolecularWeight: 409.50462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)NC4=CC=CC=C4

InChI

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