(4-azanyl-3-pyridin-2-ylcarbonyl-phenyl) thiocyanate

Systemtic Name: (4-azanyl-3-pyridin-2-ylcarbonyl-phenyl) thiocyanate Openeye Name: [4-amino-3-(pyridine-2-carbonyl)phenyl] thiocyanate CAS Name: thiocyanic acid [4-amino-3-[oxo(2-pyridinyl)methyl]phenyl] ester IUPAC Name: [4-amino-3-(pyridine-2-carbonyl)phenyl] thiocyanate Traditional Name: thiocyanic acid (4-amino-3-picolinoyl-phenyl) ester Formula: C13H9N3OS MolecularWeight: 255.29506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)C2=C(C=CC(=C2)SC#N)N

Isomeric SMILES

C1=CC=NC(=C1)C(=O)C2=C(C=CC(=C2)SC#N)N

InChI

InChI=1S/C13H9N3OS/c14-8-18-9-4-5-11(15)10(7-9)13(17)12-3-1-2-6-16-12/h1-7H,15H2