4-[3-(2,5-dimethylthiophen-3-yl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(2,5-dimethylthiophen-3-yl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(2,5-dimethyl-3-thienyl)-6-oxo-4,5-dihydropyridazin-1-yl]benzonitrile CAS Name: 4-[3-(2,5-dimethyl-3-thiophenyl)-6-oxo-4,5-dihydropyridazin-1-yl]benzonitrile IUPAC Name: 4-[3-(2,5-dimethylthiophen-3-yl)-6-oxo-4,5-dihydropyridazin-1-yl]benzonitrile Traditional Name: 4-[3-(2,5-dimethyl-3-thienyl)-6-keto-4,5-dihydropyridazin-1-yl]benzonitrile Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NN(C(=O)CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NN(C(=O)CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H15N3OS/c1-11-9-15(12(2)22-11)16-7-8-17(21)20(19-16)14-5-3-13(10-18)4-6-14/h3-6,9H,7-8H2,1-2H3