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

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(2-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[(4,6-diamino-s-triazin-2-yl)thio]acetamide Formula: C12H13ClN6OS MolecularWeight: 324.78922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N)Cl

InChI

InChI=1S/C12H13ClN6OS/c1-6-2-3-8(7(13)4-6)16-9(20)5-21-12-18-10(14)17-11(15)19-12/h2-4H,5H2,1H3,(H,16,20)(H4,14,15,17,18,19)