N6-tert-butyl-N4-(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-tert-butyl-N4-(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N6-tert-butyl-N4-(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N6-tert-butyl-N4-(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-tert-butyl-4-N-(3-chlorophenyl)pyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: tert-butyl-[4-(3-chloroanilino)pyrimido[5,4-d]pyrimidin-6-yl]amine Formula: C16H17ClN6 MolecularWeight: 328.79938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)NC1=NC=C2C(=N1)C(=NC=N2)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H17ClN6/c1-16(2,3)23-15-18-8-12-13(22-15)14(20-9-19-12)21-11-6-4-5-10(17)7-11/h4-9H,1-3H3,(H,18,22,23)(H,19,20,21)