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

Systemtic Name: 4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-[3-(4-bromophenyl)-6-keto-pyridazin-1-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C22H19BrN4O2S MolecularWeight: 483.38086

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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=C(C=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C22H19BrN4O2S/c1-14-4-9-18-19(13-14)30-22(24-18)25-20(28)3-2-12-27-21(29)11-10-17(26-27)15-5-7-16(23)8-6-15/h4-11,13H,2-3,12H2,1H3,(H,24,25,28)