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

Systemtic Name: 4-methyl-2-[4-oxidanylidene-4-(4-propylpiperazin-1-yl)butyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Openeye Name: 4-methyl-2-[4-oxo-4-(4-propylpiperazin-1-yl)butyl]benzothiopheno[2,3-d]pyridazin-1-one CAS Name: 4-methyl-2-[4-oxo-4-(4-propyl-1-piperazinyl)butyl]-[1]benzothiolo[2,3-d]pyridazin-1-one IUPAC Name: 4-methyl-2-[4-oxo-4-(4-propylpiperazin-1-yl)butyl]-[1]benzothiolo[2,3-d]pyridazin-1-one Traditional Name: 2-[4-keto-4-(4-propylpiperazino)butyl]-4-methyl-benzothiopheno[2,3-d]pyridazin-1-one Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)CCCN2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

Isomeric SMILES

CCCN1CCN(CC1)C(=O)CCCN2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

InChI

InChI=1S/C22H28N4O2S/c1-3-10-24-12-14-25(15-13-24)19(27)9-6-11-26-22(28)20-17-7-4-5-8-18(17)29-21(20)16(2)23-26/h4-5,7-8H,3,6,9-15H2,1-2H3