6-[2-(4-bromanylphenoxy)ethylsulfanyl]-N4-ethyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[2-(4-bromanylphenoxy)ethylsulfanyl]-N4-ethyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[2-(4-bromophenoxy)ethylsulfanyl]-N4-ethyl-N2-isopropyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[2-(4-bromophenoxy)ethylthio]-N4-ethyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[2-(4-bromophenoxy)ethylsulfanyl]-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-[2-(4-bromophenoxy)ethylthio]-6-(ethylamino)-s-triazin-2-yl]-isopropyl-amine Formula: C16H22BrN5OS MolecularWeight: 412.34778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)SCCOC2=CC=C(C=C2)Br)NC(C)C

Isomeric SMILES

CCNC1=NC(=NC(=N1)SCCOC2=CC=C(C=C2)Br)NC(C)C

InChI

InChI=1S/C16H22BrN5OS/c1-4-18-14-20-15(19-11(2)3)22-16(21-14)24-10-9-23-13-7-5-12(17)6-8-13/h5-8,11H,4,9-10H2,1-3H3,(H2,18,19,20,21,22)