5-chloranyl-4-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[4-(4-cyclohexylphenyl)sulfonyl-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[4-(4-cyclohexylphenyl)sulfonylpiperazino]-1H-pyridazin-6-one Formula: C20H25ClN4O3S MolecularWeight: 436.9555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C(=O)NN=C4)Cl

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C(=O)NN=C4)Cl

InChI

InChI=1S/C20H25ClN4O3S/c21-19-18(14-22-23-20(19)26)24-10-12-25(13-11-24)29(27,28)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-9,14-15H,1-5,10-13H2,(H,23,26)