2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(3-pyrrolidin-1-ylpropyl)butanamide

Systemtic Name: 2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(3-pyrrolidin-1-ylpropyl)butanamide Openeye Name: 2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(3-pyrrolidin-1-ylpropyl)butanamide CAS Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-[3-(1-pyrrolidinyl)propyl]butanamide IUPAC Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(3-pyrrolidin-1-ylpropyl)butanamide Traditional Name: 2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(3-pyrrolidinopropyl)butyramide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCCN1CCCC1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

Isomeric SMILES

CCC(C(=O)NCCCN1CCCC1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

InChI

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