2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-ethanoylphenyl)ethanamide

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-ethanoylphenyl)ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[(4,6-diamino-s-triazin-2-yl)thio]acetamide Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C13H14N6O2S/c1-7(20)8-2-4-9(5-3-8)16-10(21)6-22-13-18-11(14)17-12(15)19-13/h2-5H,6H2,1H3,(H,16,21)(H4,14,15,17,18,19)