1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-sulfanylidene-pyridin-3-ylidene]ethanolate

Systemtic Name: 1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-sulfanylidene-pyridin-3-ylidene]ethanolate Openeye Name: 1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-thioxo-3-pyridylidene]ethanolate CAS Name: 1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-sulfanylidene-3-pyridinylidene]ethanolate IUPAC Name: 1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-sulfanylidenepyridin-3-ylidene]ethanolate Traditional Name: 1-[5-cyano-2-methyl-4-(4-nitrophenyl)-6-thioxo-3-pyridylidene]ethanolate Formula: C15H10N3O3S- MolecularWeight: 312.3232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O3S/c1-8-13(9(2)19)14(12(7-16)15(22)17-8)10-3-5-11(6-4-10)18(20)21/h3-6,19H,1-2H3/p-1