4-methyl-2-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]-[1]benzothiolo[2,3-d]pyridazin-1-one

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Openeye Name: 4-methyl-2-[2-oxo-2-[4-(1-piperidyl)-1-piperidyl]ethyl]benzothiopheno[2,3-d]pyridazin-1-one CAS Name: 4-methyl-2-[2-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]ethyl]-[1]benzothiolo[2,3-d]pyridazin-1-one IUPAC Name: 4-methyl-2-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Traditional Name: 2-[2-keto-2-(4-piperidinopiperidino)ethyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CC(=O)N4CCC(CC4)N5CCCCC5

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CC(=O)N4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C23H28N4O2S/c1-16-22-21(18-7-3-4-8-19(18)30-22)23(29)27(24-16)15-20(28)26-13-9-17(10-14-26)25-11-5-2-6-12-25/h3-4,7-8,17H,2,5-6,9-15H2,1H3