4-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-3-nitro-benzamide

Systemtic Name: 4-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanyl-3-nitro-benzamide Openeye Name: 4-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]-3-nitro-benzamide CAS Name: 4-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-3-nitrobenzamide IUPAC Name: 4-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl-3-nitrobenzamide Traditional Name: 4-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]-3-nitro-benzamide Formula: C16H14N4O3S MolecularWeight: 342.37236

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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)N)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O3S/c1-8-9(2)12(7-17)16(19-10(8)3)24-14-5-4-11(15(18)21)6-13(14)20(22)23/h4-6H,1-3H3,(H2,18,21)