2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-4-phenyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylthio]-4-phenyl-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[2-(4-chlorobenzyl)sulfonylethylthio]-4-phenyl-6-(2-thienyl)nicotinonitrile Formula: C25H19ClN2O2S3 MolecularWeight: 511.07856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCS(=O)(=O)CC3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCS(=O)(=O)CC3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C25H19ClN2O2S3/c26-20-10-8-18(9-11-20)17-33(29,30)14-13-32-25-22(16-27)21(19-5-2-1-3-6-19)15-23(28-25)24-7-4-12-31-24/h1-12,15H,13-14,17H2