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

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-butylphenyl)ethanamide Openeye Name: N-(4-butylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide CAS Name: N-(4-butylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-butylphenyl)-2-[(4,6-diamino-s-triazin-2-yl)thio]acetamide Formula: C15H20N6OS MolecularWeight: 332.4239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C15H20N6OS/c1-2-3-4-10-5-7-11(8-6-10)18-12(22)9-23-15-20-13(16)19-14(17)21-15/h5-8H,2-4,9H2,1H3,(H,18,22)(H4,16,17,19,20,21)