2-[(3,4-dichlorophenyl)methylsulfanyl]-4,6-dithiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-4,6-dithiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-4,6-bis(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-4,6-dithiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-4,6-dithiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-4,6-bis(2-thienyl)nicotinonitrile Formula: C21H12Cl2N2S3 MolecularWeight: 459.43438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NC(=C2C#N)SCC3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NC(=C2C#N)SCC3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4

InChI

InChI=1S/C21H12Cl2N2S3/c22-16-6-5-13(9-17(16)23)12-28-21-15(11-24)14(19-3-1-7-26-19)10-18(25-21)20-4-2-8-27-20/h1-10H,12H2