1-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[(4,6-diamino-1,3,5-triazin-2-yl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[(4,6-diamino-s-triazin-2-yl)thio]-3,3-dimethyl-butan-2-one Formula: C9H15N5OS MolecularWeight: 241.3133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC(=NC(=N1)N)N

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC(=NC(=N1)N)N

InChI

InChI=1S/C9H15N5OS/c1-9(2,3)5(15)4-16-8-13-6(10)12-7(11)14-8/h4H2,1-3H3,(H4,10,11,12,13,14)