3-(pyridin-3-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(pyridin-3-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(3-pyridylmethyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(3-pyridinylmethyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(pyridin-3-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(3-pyridylmethyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C16H12N4O MolecularWeight: 276.29268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C=N3)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C=N3)CC4=CN=CC=C4

InChI

InChI=1S/C16H12N4O/c21-16-15-14(12-5-1-2-6-13(12)19-15)18-10-20(16)9-11-4-3-7-17-8-11/h1-8,10,19H,9H2