3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-3-yl-benzamide

Systemtic Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-3-yl-benzamide Openeye Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-(3-quinolyl)benzamide CAS Name: 3-[(2-pyrazinylthio)methyl]-N-(3-quinolinyl)benzamide IUPAC Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-3-ylbenzamide Traditional Name: 3-[(pyrazin-2-ylthio)methyl]-N-(3-quinolyl)benzamide Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC(=CC=C3)CSC4=NC=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC(=CC=C3)CSC4=NC=CN=C4

InChI

InChI=1S/C21H16N4OS/c26-21(25-18-11-16-5-1-2-7-19(16)24-12-18)17-6-3-4-15(10-17)14-27-20-13-22-8-9-23-20/h1-13H,14H2,(H,25,26)