N-(4-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(4-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(4-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(4-nitrophenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(4-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(4-nitrophenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C19H14N4O3S MolecularWeight: 378.40446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C3C(=C1)NC(=NC3=CC=C2)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O3S/c24-17(20-13-7-9-14(10-8-13)23(25)26)11-27-19-21-15-5-1-3-12-4-2-6-16(22-19)18(12)15/h1-10H,11H2,(H,20,24)(H,21,22)