2-(2-cyanophenyl)sulfanyl-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-(4-pyridylmethyl)benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-(4-pyridylmethyl)benzamide Formula: C20H15N3OS MolecularWeight: 345.4176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C20H15N3OS/c21-13-16-5-1-3-7-18(16)25-19-8-4-2-6-17(19)20(24)23-14-15-9-11-22-12-10-15/h1-12H,14H2,(H,23,24)