2-(4-ethanoyl-2-nitro-phenyl)sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-(4-ethanoyl-2-nitro-phenyl)sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-(4-acetyl-2-nitro-phenyl)sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[(4-acetyl-2-nitrophenyl)thio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(4-acetyl-2-nitrophenyl)sulfanyl-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 2-[(4-acetyl-2-nitro-phenyl)thio]-4,5,6-trimethyl-nicotinonitrile Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N3O3S/c1-9-10(2)14(8-18)17(19-11(9)3)24-16-6-5-13(12(4)21)7-15(16)20(22)23/h5-7H,1-4H3