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

Systemtic Name: 8-bromanyl-3-(pyridin-4-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 8-bromo-3-(4-pyridylmethyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-bromo-3-(pyridin-4-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 8-bromo-3-(pyridin-4-ylmethyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 8-bromo-3-(4-pyridylmethyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C16H11BrN4O MolecularWeight: 355.18874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C=N3)CC4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C=N3)CC4=CC=NC=C4

InChI

InChI=1S/C16H11BrN4O/c17-11-1-2-13-12(7-11)14-15(20-13)16(22)21(9-19-14)8-10-3-5-18-6-4-10/h1-7,9,20H,8H2