N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-oxo-pyridazin-1-yl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-oxo-1-pyridazinyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1-yl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[3-(2,5-dimethylphenyl)-6-keto-pyridazin-1-yl]acetamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C=C2)CC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C=C2)CC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N4O2S/c1-13-7-8-14(2)15(11-13)16-9-10-20(27)25(24-16)12-19(26)23-21-22-17-5-3-4-6-18(17)28-21/h3-11H,12H2,1-2H3,(H,22,23,26)