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

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-4,6-dithiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-4,6-bis(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(4-nitrophenyl)methylthio]-4,6-dithiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-4,6-dithiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(4-nitrobenzyl)thio]-4,6-bis(2-thienyl)nicotinonitrile Formula: C21H13N3O2S3 MolecularWeight: 435.54182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NC(=C2C#N)SCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NC(=C2C#N)SCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C21H13N3O2S3/c22-12-17-16(19-3-1-9-27-19)11-18(20-4-2-10-28-20)23-21(17)29-13-14-5-7-15(8-6-14)24(25)26/h1-11H,13H2