3-(pyridin-4-ylmethoxy)benzenecarbothioamide

Systemtic Name: 3-(pyridin-4-ylmethoxy)benzenecarbothioamide Openeye Name: 3-(4-pyridylmethoxy)benzenecarbothioamide CAS Name: 3-(pyridin-4-ylmethoxy)benzenecarbothioamide IUPAC Name: 3-(pyridin-4-ylmethoxy)benzenecarbothioamide Traditional Name: 3-(4-pyridylmethoxy)thiobenzamide Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC=NC=C2)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC=NC=C2)C(=S)N

InChI

InChI=1S/C13H12N2OS/c14-13(17)11-2-1-3-12(8-11)16-9-10-4-6-15-7-5-10/h1-8H,9H2,(H2,14,17)