8-bromanyl-2-[(pyridin-3-ylamino)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Systemtic Name: 8-bromanyl-2-[(pyridin-3-ylamino)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Openeye Name: 8-bromo-2-[(3-pyridylamino)methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one CAS Name: 8-bromo-2-[(3-pyridinylamino)methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one IUPAC Name: 8-bromo-2-[(pyridin-3-ylamino)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one Traditional Name: 8-bromo-2-[(3-pyridylamino)methyl]-1H-benzofuro[3,2-d]pyrimidin-4-one Formula: C16H11BrN4O2 MolecularWeight: 371.18814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NCC2=NC(=O)C3=C(N2)C4=C(O3)C=CC(=C4)Br

Isomeric SMILES

C1=CC(=CN=C1)NCC2=NC(=O)C3=C(N2)C4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C16H11BrN4O2/c17-9-3-4-12-11(6-9)14-15(23-12)16(22)21-13(20-14)8-19-10-2-1-5-18-7-10/h1-7,19H,8H2,(H,20,21,22)