4-(5-butylthiophen-2-yl)-6-(2,5-dimethylphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 4-(5-butylthiophen-2-yl)-6-(2,5-dimethylphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 4-(5-butyl-2-thienyl)-6-(2,5-dimethylphenyl)-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 4-(5-butyl-2-thiophenyl)-6-(2,5-dimethylphenyl)-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 4-(5-butylthiophen-2-yl)-6-(2,5-dimethylphenyl)-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 4-(5-butyl-2-thienyl)-6-(2,5-dimethylphenyl)-2-keto-1H-pyridine-3-carbonitrile Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)C)C)C#N

Isomeric SMILES

CCCCC1=CC=C(S1)C2=C(C(=O)NC(=C2)C3=C(C=CC(=C3)C)C)C#N

InChI

InChI=1S/C22H22N2OS/c1-4-5-6-16-9-10-21(26-16)18-12-20(24-22(25)19(18)13-23)17-11-14(2)7-8-15(17)3/h7-12H,4-6H2,1-3H3,(H,24,25)