2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-4,6-dithiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-4,6-dithiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-(4-oxo-4-phenyl-butyl)sulfanyl-4,6-bis(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(4-oxo-4-phenylbutyl)thio]-4,6-dithiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-(4-oxo-4-phenylbutyl)sulfanyl-4,6-dithiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(4-keto-4-phenyl-butyl)thio]-4,6-bis(2-thienyl)nicotinonitrile Formula: C24H18N2OS3 MolecularWeight: 446.60752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CS4)C#N

InChI

InChI=1S/C24H18N2OS3/c25-16-19-18(22-10-5-12-28-22)15-20(23-11-6-13-29-23)26-24(19)30-14-4-9-21(27)17-7-2-1-3-8-17/h1-3,5-8,10-13,15H,4,9,14H2