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

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(4,6-diamino-s-triazin-2-yl)thio]acetamide Formula: C12H13BrN6OS MolecularWeight: 369.24022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrN6OS/c1-6-4-7(13)2-3-8(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)