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

Systemtic Name: N4-(3-chlorophenyl)-N6-piperidin-4-yl-pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chlorophenyl)-N6-(4-piperidyl)pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chlorophenyl)-N6-(4-piperidinyl)pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chlorophenyl)-6-N-piperidin-4-ylpyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3-chloroanilino)pyrimido[5,4-d]pyrimidin-6-yl]-(4-piperidyl)amine Formula: C17H18ClN7 MolecularWeight: 355.82472

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CNCCC1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H18ClN7/c18-11-2-1-3-13(8-11)23-16-15-14(21-10-22-16)9-20-17(25-15)24-12-4-6-19-7-5-12/h1-3,8-10,12,19H,4-7H2,(H,20,24,25)(H,21,22,23)