6-cyclopropyl-2-[(4-nitrophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 6-cyclopropyl-2-[(4-nitrophenyl)methylsulfanyl]-4-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 6-cyclopropyl-2-[(4-nitrophenyl)methylsulfanyl]-4-(2-thienyl)pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-2-[(4-nitrophenyl)methylthio]-4-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 6-cyclopropyl-2-[(4-nitrophenyl)methylsulfanyl]-4-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 6-cyclopropyl-2-[(4-nitrobenzyl)thio]-4-(2-thienyl)nicotinonitrile Formula: C20H15N3O2S2 MolecularWeight: 393.482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C(=C2)C3=CC=CS3)C#N)SCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NC(=C(C(=C2)C3=CC=CS3)C#N)SCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O2S2/c21-11-17-16(19-2-1-9-26-19)10-18(14-5-6-14)22-20(17)27-12-13-3-7-15(8-4-13)23(24)25/h1-4,7-10,14H,5-6,12H2