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

Systemtic Name: 1-[5-cyano-2-methyl-4-(2-nitrophenyl)-6-sulfanyl-4H-pyridin-3-ylidene]ethanolate Openeye Name: 1-[5-cyano-2-methyl-4-(2-nitrophenyl)-6-sulfanyl-4H-pyridin-3-ylidene]ethanolate CAS Name: 1-[5-cyano-6-mercapto-2-methyl-4-(2-nitrophenyl)-4H-pyridin-3-ylidene]ethanolate IUPAC Name: 1-[5-cyano-2-methyl-4-(2-nitrophenyl)-6-sulfanyl-4H-pyridin-3-ylidene]ethanolate Traditional Name: 1-[5-cyano-6-mercapto-2-methyl-4-(2-nitrophenyl)-4H-pyridin-3-ylidene]ethanolate Formula: C15H12N3O3S- MolecularWeight: 314.33908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O3S/c1-8-13(9(2)19)14(11(7-16)15(22)17-8)10-5-3-4-6-12(10)18(20)21/h3-6,14,19,22H,1-2H3/p-1