6-[(3R)-3-(methylamino)pyrrolidin-1-yl]-N4-(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 6-[(3R)-3-(methylamino)pyrrolidin-1-yl]-N4-(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N4-benzyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidine-2,4-diamine CAS Name: 6-[(3R)-3-(methylamino)-1-pyrrolidinyl]-N4-(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-benzyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidine-2,4-diamine Traditional Name: [(3R)-1-[2-amino-6-(benzylamino)pyrimidin-4-yl]pyrrolidin-3-yl]-methyl-amine Formula: C16H22N6 MolecularWeight: 298.38608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1CCN(C1)C2=CC(=NC(=N2)N)NCC3=CC=CC=C3

Isomeric SMILES

CN[C@@H]1CCN(C1)C2=CC(=NC(=N2)N)NCC3=CC=CC=C3

InChI

InChI=1S/C16H22N6/c1-18-13-7-8-22(11-13)15-9-14(20-16(17)21-15)19-10-12-5-3-2-4-6-12/h2-6,9,13,18H,7-8,10-11H2,1H3,(H3,17,19,20,21)/t13-/m1/s1