5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(7,9,9-trimethyl-10H-1,10-phenanthrolin-5-yl)methyl]pyrimidin-4-yl]amine Formula: C20H22N6 MolecularWeight: 346.42888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C3C(=C(C=C12)CC4=CN=C(N=C4N)N)C=CC=N3)(C)C

Isomeric SMILES

CC1=CC(NC2=C3C(=C(C=C12)CC4=CN=C(N=C4N)N)C=CC=N3)(C)C

InChI

InChI=1S/C20H22N6/c1-11-9-20(2,3)26-17-15(11)8-12(14-5-4-6-23-16(14)17)7-13-10-24-19(22)25-18(13)21/h4-6,8-10,26H,7H2,1-3H3,(H4,21,22,24,25)