N-(pyridin-3-ylmethyl)-2-sulfanyl-benzamide

Systemtic Name: N-(pyridin-3-ylmethyl)-2-sulfanyl-benzamide Openeye Name: N-(3-pyridylmethyl)-2-sulfanyl-benzamide CAS Name: 2-mercapto-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-(pyridin-3-ylmethyl)-2-sulfanylbenzamide Traditional Name: 2-mercapto-N-(3-pyridylmethyl)benzamide Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CN=CC=C2)S

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CN=CC=C2)S

InChI

InChI=1S/C13H12N2OS/c16-13(11-5-1-2-6-12(11)17)15-9-10-4-3-7-14-8-10/h1-8,17H,9H2,(H,15,16)