4-oxidanylidene-N-(pyridin-2-ylmethyl)-1H-quinazoline-2-carbothioamide

Systemtic Name: 4-oxidanylidene-N-(pyridin-2-ylmethyl)-1H-quinazoline-2-carbothioamide Openeye Name: 4-oxo-N-(2-pyridylmethyl)-1H-quinazoline-2-carbothioamide CAS Name: 4-oxo-N-(2-pyridinylmethyl)-1H-quinazoline-2-carbothioamide IUPAC Name: 4-oxo-N-(pyridin-2-ylmethyl)-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(2-pyridylmethyl)-1H-quinazoline-2-carbothioamide Formula: C15H12N4OS MolecularWeight: 296.34698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NCC3=CC=CC=N3

InChI

InChI=1S/C15H12N4OS/c20-14-11-6-1-2-7-12(11)18-13(19-14)15(21)17-9-10-5-3-4-8-16-10/h1-8H,9H2,(H,17,21)(H,18,19,20)