6-(1-chloroethyl)-N2-(1-phenoxybutan-2-yl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1-chloroethyl)-N2-(1-phenoxybutan-2-yl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1-chloroethyl)-N2-[1-(phenoxymethyl)propyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-(1-chloroethyl)-N2-(1-phenoxybutan-2-yl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1-chloroethyl)-2-N-(1-phenoxybutan-2-yl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(1-chloroethyl)-s-triazin-2-yl]-[1-(phenoxymethyl)propyl]amine Formula: C15H20ClN5O MolecularWeight: 321.8052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC=CC=C1)NC2=NC(=NC(=N2)N)C(C)Cl

Isomeric SMILES

CCC(COC1=CC=CC=C1)NC2=NC(=NC(=N2)N)C(C)Cl

InChI

InChI=1S/C15H20ClN5O/c1-3-11(9-22-12-7-5-4-6-8-12)18-15-20-13(10(2)16)19-14(17)21-15/h4-8,10-11H,3,9H2,1-2H3,(H3,17,18,19,20,21)