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

Systemtic Name: 4-methyl-2-[4-(4-methylpiperazin-1-yl)-4-oxidanylidene-butyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Openeye Name: 4-methyl-2-[4-(4-methylpiperazin-1-yl)-4-oxo-butyl]benzothiopheno[2,3-d]pyridazin-1-one CAS Name: 4-methyl-2-[4-(4-methyl-1-piperazinyl)-4-oxobutyl]-[1]benzothiolo[2,3-d]pyridazin-1-one IUPAC Name: 4-methyl-2-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Traditional Name: 2-[4-keto-4-(4-methylpiperazino)butyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O2S/c1-14-19-18(15-6-3-4-7-16(15)27-19)20(26)24(21-14)9-5-8-17(25)23-12-10-22(2)11-13-23/h3-4,6-7H,5,8-13H2,1-2H3