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

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[(4,6-diamino-s-triazin-2-yl)thio]-N-(2,3-dimethylphenyl)acetamide Formula: C13H16N6OS MolecularWeight: 304.37074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N6OS/c1-7-4-3-5-9(8(7)2)16-10(20)6-21-13-18-11(14)17-12(15)19-13/h3-5H,6H2,1-2H3,(H,16,20)(H4,14,15,17,18,19)