3-(pyrazin-2-ylsulfanylmethyl)-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Openeye Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-[4-(4-pyridylmethyl)phenyl]benzamide CAS Name: 3-[(2-pyrazinylthio)methyl]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide IUPAC Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide Traditional Name: 3-[(pyrazin-2-ylthio)methyl]-N-[4-(4-pyridylmethyl)phenyl]benzamide Formula: C24H20N4OS MolecularWeight: 412.5068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NC=CN=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NC=CN=C2)C(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4

InChI

InChI=1S/C24H20N4OS/c29-24(21-3-1-2-20(15-21)17-30-23-16-26-12-13-27-23)28-22-6-4-18(5-7-22)14-19-8-10-25-11-9-19/h1-13,15-16H,14,17H2,(H,28,29)