N-(3-ethanoylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(3-acetylphenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(3-acetylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(3-acetylphenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C21H17N3O2S/c1-13(25)15-7-2-8-16(11-15)22-19(26)12-27-21-23-17-9-3-5-14-6-4-10-18(24-21)20(14)17/h2-11H,12H2,1H3,(H,22,26)(H,23,24)