4-(2,5-dimethoxyphenyl)-6-naphthalen-1-yl-2-(3-nitropyridin-2-yl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4-(2,5-dimethoxyphenyl)-6-naphthalen-1-yl-2-(3-nitropyridin-2-yl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 4-(2,5-dimethoxyphenyl)-6-(1-naphthyl)-2-[(3-nitro-2-pyridyl)sulfanyl]pyridine-3-carbonitrile CAS Name: 4-(2,5-dimethoxyphenyl)-6-(1-naphthalenyl)-2-[(3-nitro-2-pyridinyl)thio]-3-pyridinecarbonitrile IUPAC Name: 4-(2,5-dimethoxyphenyl)-6-naphthalen-1-yl-2-(3-nitropyridin-2-yl)sulfanylpyridine-3-carbonitrile Traditional Name: 4-(2,5-dimethoxyphenyl)-6-(1-naphthyl)-2-[(3-nitro-2-pyridyl)thio]nicotinonitrile Formula: C29H20N4O4S MolecularWeight: 520.5585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SC3=C(C=CC=N3)[N+](=O)[O-])C4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SC3=C(C=CC=N3)[N+](=O)[O-])C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H20N4O4S/c1-36-19-12-13-27(37-2)23(15-19)22-16-25(21-10-5-8-18-7-3-4-9-20(18)21)32-28(24(22)17-30)38-29-26(33(34)35)11-6-14-31-29/h3-16H,1-2H3