[(2-pyrazol-1-ylpyridin-4-yl)methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [(2-pyrazol-1-ylpyridin-4-yl)methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [(2-pyrazol-1-yl-4-pyridyl)methylamino]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [[2-(1-pyrazolyl)-4-pyridinyl]methylamino]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [(2-pyrazol-1-ylpyridin-4-yl)methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [(2-pyrazol-1-yl-4-pyridyl)methylamino]-(2-thioxo-3-pyridylidene)methanolate Formula: C15H12N5OS- MolecularWeight: 310.35368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(NCC2=CC(=NC=C2)N3C=CC=N3)[O-])C(=S)N=C1

Isomeric SMILES

C1=CC(=C(NCC2=CC(=NC=C2)N3C=CC=N3)[O-])C(=S)N=C1

InChI

InChI=1S/C15H13N5OS/c21-14(12-3-1-5-17-15(12)22)18-10-11-4-7-16-13(9-11)20-8-2-6-19-20/h1-9,18,21H,10H2/p-1