S-quinazolin-4-yl pyridine-3-carbothioate

Systemtic Name: S-quinazolin-4-yl pyridine-3-carbothioate Openeye Name: S-quinazolin-4-yl pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-(4-quinazolinyl) ester IUPAC Name: S-quinazolin-4-yl pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-quinazolin-4-yl ester Formula: C14H9N3OS MolecularWeight: 267.30576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SC(=O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SC(=O)C3=CN=CC=C3

InChI

InChI=1S/C14H9N3OS/c18-14(10-4-3-7-15-8-10)19-13-11-5-1-2-6-12(11)16-9-17-13/h1-9H