2-[4-(4-cyclohexylpiperazin-1-yl)-4-oxidanylidene-butyl]-4-methyl-[1]benzothiolo[2,3-d]pyridazin-1-one

Systemtic Name: 2-[4-(4-cyclohexylpiperazin-1-yl)-4-oxidanylidene-butyl]-4-methyl-[1]benzothiolo[2,3-d]pyridazin-1-one Openeye Name: 2-[4-(4-cyclohexylpiperazin-1-yl)-4-oxo-butyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one CAS Name: 2-[4-(4-cyclohexyl-1-piperazinyl)-4-oxobutyl]-4-methyl-[1]benzothiolo[2,3-d]pyridazin-1-one IUPAC Name: 2-[4-(4-cyclohexylpiperazin-1-yl)-4-oxobutyl]-4-methyl-[1]benzothiolo[2,3-d]pyridazin-1-one Traditional Name: 2-[4-(4-cyclohexylpiperazino)-4-keto-butyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one Formula: C25H32N4O2S MolecularWeight: 452.61218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)N4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)N4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C25H32N4O2S/c1-18-24-23(20-10-5-6-11-21(20)32-24)25(31)29(26-18)13-7-12-22(30)28-16-14-27(15-17-28)19-8-3-2-4-9-19/h5-6,10-11,19H,2-4,7-9,12-17H2,1H3