N-(2-ethyl-6-methyl-phenyl)-4-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-4-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-4-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)butanamide CAS Name: N-(2-ethyl-6-methylphenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-4-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)butyramide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCCN2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCCN2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43)C

InChI

InChI=1S/C24H25N3O2S/c1-4-17-10-7-9-15(2)22(17)25-20(28)13-8-14-27-24(29)21-18-11-5-6-12-19(18)30-23(21)16(3)26-27/h5-7,9-12H,4,8,13-14H2,1-3H3,(H,25,28)