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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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