7,8-dimethoxy-N-quinolin-6-yl-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: 7,8-dimethoxy-N-quinolin-6-yl-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: 7,8-dimethoxy-N-(6-quinolyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: 7,8-dimethoxy-N-(6-quinolinyl)-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: 7,8-dimethoxy-N-quinolin-6-yl-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (7,8-dimethoxy-5H-pyrimid[5,4-b]indol-4-yl)-(6-quinolyl)amine Formula: C21H17N5O2 MolecularWeight: 371.39198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)NC4=CC5=C(C=C4)N=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)NC4=CC5=C(C=C4)N=CC=C5)OC

InChI

InChI=1S/C21H17N5O2/c1-27-17-9-14-16(10-18(17)28-2)26-20-19(14)23-11-24-21(20)25-13-5-6-15-12(8-13)4-3-7-22-15/h3-11,26H,1-2H3,(H,23,24,25)