6-[[4-chloranyl-2-(phenylmethyl)phenoxy]methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[4-chloranyl-2-(phenylmethyl)phenoxy]methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(2-benzyl-4-chloro-phenoxy)methyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[4-chloro-2-(phenylmethyl)phenoxy]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(2-benzyl-4-chlorophenoxy)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(2-benzyl-4-chloro-phenoxy)methyl]-s-triazin-2-yl]amine Formula: C17H16ClN5O MolecularWeight: 341.79484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C17H16ClN5O/c18-13-6-7-14(12(9-13)8-11-4-2-1-3-5-11)24-10-15-21-16(19)23-17(20)22-15/h1-7,9H,8,10H2,(H4,19,20,21,22,23)