4-(azepan-1-yl)-2,8-bis(chloranyl)pyrimido[5,4-d]pyrimidine

Systemtic Name: 4-(azepan-1-yl)-2,8-bis(chloranyl)pyrimido[5,4-d]pyrimidine Openeye Name: 4-(azepan-1-yl)-2,8-dichloro-pyrimido[5,4-d]pyrimidine CAS Name: 4-(1-azepanyl)-2,8-dichloropyrimido[5,4-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-2,8-dichloropyrimido[5,4-d]pyrimidine Traditional Name: 4-(azepan-1-yl)-2,8-dichloro-pyrimido[5,4-d]pyrimidine Formula: C12H13Cl2N5 MolecularWeight: 298.17112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2N=CN=C3Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2N=CN=C3Cl)Cl

InChI

InChI=1S/C12H13Cl2N5/c13-10-8-9(15-7-16-10)11(18-12(14)17-8)19-5-3-1-2-4-6-19/h7H,1-6H2