2-(2,5-dimethoxyphenyl)sulfanyl-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 2-(2,5-dimethoxyphenyl)sulfanyl-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile Openeye Name: 2-(2,5-dimethoxyphenyl)sulfanyl-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile CAS Name: 2-[(2,5-dimethoxyphenyl)thio]-4,6-dimethyl-5-nitro-3-pyridinecarbonitrile IUPAC Name: 2-(2,5-dimethoxyphenyl)sulfanyl-4,6-dimethyl-5-nitropyridine-3-carbonitrile Traditional Name: 2-[(2,5-dimethoxyphenyl)thio]-4,6-dimethyl-5-nitro-nicotinonitrile Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1[N+](=O)[O-])C)SC2=C(C=CC(=C2)OC)OC)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1[N+](=O)[O-])C)SC2=C(C=CC(=C2)OC)OC)C#N

InChI

InChI=1S/C16H15N3O4S/c1-9-12(8-17)16(18-10(2)15(9)19(20)21)24-14-7-11(22-3)5-6-13(14)23-4/h5-7H,1-4H3