N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: N6-[(2-chlorophenyl)methyl]-5-nitro-N4-(2-oxolanylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[(2-chlorophenyl)methyl]-5-nitro-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[5-nitro-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]amine Formula: C16H18ClN5O3 MolecularWeight: 363.79882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H18ClN5O3/c17-13-6-2-1-4-11(13)8-18-15-14(22(23)24)16(21-10-20-15)19-9-12-5-3-7-25-12/h1-2,4,6,10,12H,3,5,7-9H2,(H2,18,19,20,21)