6-[1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[1-[4-(1-azepanylsulfonyl)-1-piperazinyl]ethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]ethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[1-[4-(azepan-1-ylsulfonyl)piperazino]ethyl]-s-triazin-2-yl]-phenyl-amine Formula: C21H32N8O2S MolecularWeight: 460.59618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C21H32N8O2S/c1-17(19-24-20(22)26-21(25-19)23-18-9-5-4-6-10-18)27-13-15-29(16-14-27)32(30,31)28-11-7-2-3-8-12-28/h4-6,9-10,17H,2-3,7-8,11-16H2,1H3,(H3,22,23,24,25,26)