4-methyl-2-[1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-[1]benzothiolo[2,3-d]pyridazin-1-one

Systemtic Name: 4-methyl-2-[1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-[1]benzothiolo[2,3-d]pyridazin-1-one Openeye Name: 4-methyl-2-[1-methyl-2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]benzothiopheno[2,3-d]pyridazin-1-one CAS Name: 4-methyl-2-[1-oxo-1-[4-(2-pyridinyl)-1-piperazinyl]propan-2-yl]-[1]benzothiolo[2,3-d]pyridazin-1-one IUPAC Name: 4-methyl-2-[1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-[1]benzothiolo[2,3-d]pyridazin-1-one Traditional Name: 2-[2-keto-1-methyl-2-[4-(2-pyridyl)piperazino]ethyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C23H23N5O2S/c1-15-21-20(17-7-3-4-8-18(17)31-21)23(30)28(25-15)16(2)22(29)27-13-11-26(12-14-27)19-9-5-6-10-24-19/h3-10,16H,11-14H2,1-2H3