3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-6-yl-benzamide

Systemtic Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-6-yl-benzamide Openeye Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-(6-quinolyl)benzamide CAS Name: 3-[(2-pyrazinylthio)methyl]-N-(6-quinolinyl)benzamide IUPAC Name: 3-(pyrazin-2-ylsulfanylmethyl)-N-quinolin-6-ylbenzamide Traditional Name: 3-[(pyrazin-2-ylthio)methyl]-N-(6-quinolyl)benzamide Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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