N-(6-methyl-1,3-benzothiazol-2-yl)-4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-(6-oxo-3-phenyl-pyridazin-1-yl)butanamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-(6-oxo-3-phenyl-1-pyridazinyl)butanamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-(6-oxo-3-phenylpyridazin-1-yl)butanamide Traditional Name: 4-(6-keto-3-phenyl-pyridazin-1-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-15-9-10-18-19(14-15)29-22(23-18)24-20(27)8-5-13-26-21(28)12-11-17(25-26)16-6-3-2-4-7-16/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,23,24,27)