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

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(2-oxolanylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-chlorobenzyl)amino]pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C16H20ClN5O MolecularWeight: 333.8159

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2N)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2N)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN5O/c17-12-5-3-11(4-6-12)8-19-15-14(18)16(22-10-21-15)20-9-13-2-1-7-23-13/h3-6,10,13H,1-2,7-9,18H2,(H2,19,20,21,22)