5-(2-nitrophenyl)sulfanyl-1-(phenylmethyl)-4H-pyridine-3-carbonitrile

Systemtic Name: 5-(2-nitrophenyl)sulfanyl-1-(phenylmethyl)-4H-pyridine-3-carbonitrile Openeye Name: 1-benzyl-5-(2-nitrophenyl)sulfanyl-4H-pyridine-3-carbonitrile CAS Name: 5-[(2-nitrophenyl)thio]-1-(phenylmethyl)-4H-pyridine-3-carbonitrile IUPAC Name: 1-benzyl-5-(2-nitrophenyl)sulfanyl-4H-pyridine-3-carbonitrile Traditional Name: 1-benzyl-5-[(2-nitrophenyl)thio]-4H-pyridine-3-carbonitrile Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CN(C=C1SC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3)C#N

Isomeric SMILES

C1C(=CN(C=C1SC2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H15N3O2S/c20-11-16-10-17(25-19-9-5-4-8-18(19)22(23)24)14-21(13-16)12-15-6-2-1-3-7-15/h1-9,13-14H,10,12H2