5-(2-azanyl-1H-imidazol-5-yl)-7-bromanyl-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one

Systemtic Name: 5-(2-azanyl-1H-imidazol-5-yl)-7-bromanyl-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Openeye Name: 5-(2-amino-1H-imidazol-5-yl)-7-bromo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one CAS Name: 5-(2-amino-1H-imidazol-5-yl)-7-bromo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one IUPAC Name: 5-(2-amino-1H-imidazol-5-yl)-7-bromo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Traditional Name: 5-(2-amino-1H-imidazol-5-yl)-7-bromo-3,4,5,10-tetrahydro-2H-azepin[3,4-b]indol-1-one Formula: C15H14BrN5O MolecularWeight: 360.20856

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C(C1C3=CN=C(N3)N)C4=C(N2)C=CC(=C4)Br

Isomeric SMILES

C1CNC(=O)C2=C(C1C3=CN=C(N3)N)C4=C(N2)C=CC(=C4)Br

InChI

InChI=1S/C15H14BrN5O/c16-7-1-2-10-9(5-7)12-8(11-6-19-15(17)21-11)3-4-18-14(22)13(12)20-10/h1-2,5-6,8,20H,3-4H2,(H,18,22)(H3,17,19,21)