N-(2-methylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(2-methylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(o-tolyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(2-methylphenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(2-methylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(o-tolyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C20H17N3OS/c1-13-6-2-3-9-15(13)21-18(24)12-25-20-22-16-10-4-7-14-8-5-11-17(23-20)19(14)16/h2-11H,12H2,1H3,(H,21,24)(H,22,23)