2-[2-(2-cyanophenyl)sulfanylphenyl]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[2-(2-cyanophenyl)sulfanylphenyl]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-[2-(2-cyanophenyl)sulfanylphenyl]-N-[4-(4-pyridylmethyl)phenyl]acetamide CAS Name: 2-[2-[(2-cyanophenyl)thio]phenyl]-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide IUPAC Name: 2-[2-(2-cyanophenyl)sulfanylphenyl]-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-[2-[(2-cyanophenyl)thio]phenyl]-N-[4-(4-pyridylmethyl)phenyl]acetamide Formula: C27H21N3OS MolecularWeight: 435.54014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)SC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)SC4=CC=CC=C4C#N

InChI

InChI=1S/C27H21N3OS/c28-19-23-6-2-4-8-26(23)32-25-7-3-1-5-22(25)18-27(31)30-24-11-9-20(10-12-24)17-21-13-15-29-16-14-21/h1-16H,17-18H2,(H,30,31)