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

Systemtic Name: N-(4-acetamidophenyl)-4-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide Openeye Name: N-(4-acetamidophenyl)-4-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)butanamide CAS Name: N-(4-acetamidophenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide IUPAC Name: N-(4-acetamidophenyl)-4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide Traditional Name: N-(4-acetamidophenyl)-4-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)butyramide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)NC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)NC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C23H22N4O3S/c1-14-22-21(18-6-3-4-7-19(18)31-22)23(30)27(26-14)13-5-8-20(29)25-17-11-9-16(10-12-17)24-15(2)28/h3-4,6-7,9-12H,5,8,13H2,1-2H3,(H,24,28)(H,25,29)