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

Systemtic Name: 2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(4-phenylbutan-2-yl)butanamide Openeye Name: 2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(1-methyl-3-phenyl-propyl)butanamide CAS Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(4-phenylbutan-2-yl)butanamide IUPAC Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(4-phenylbutan-2-yl)butanamide Traditional Name: 2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(1-methyl-3-phenyl-propyl)butyramide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C)CCC1=CC=CC=C1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

Isomeric SMILES

CCC(C(=O)NC(C)CCC1=CC=CC=C1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

InChI

InChI=1S/C25H27N3O2S/c1-4-20(24(29)26-16(2)14-15-18-10-6-5-7-11-18)28-25(30)22-19-12-8-9-13-21(19)31-23(22)17(3)27-28/h5-13,16,20H,4,14-15H2,1-3H3,(H,26,29)