N4-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine

Systemtic Name: N4-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine Openeye Name: N4-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine CAS Name: N4-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine IUPAC Name: 4-N-(3-bromophenyl)-9H-pyrimido[4,5-b]indole-2,4-diamine Traditional Name: (2-amino-9H-pyrimid[4,5-b]indol-4-yl)-(3-bromophenyl)amine Formula: C16H12BrN5 MolecularWeight: 354.20398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)N=C(N=C3NC4=CC(=CC=C4)Br)N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)N=C(N=C3NC4=CC(=CC=C4)Br)N

InChI

InChI=1S/C16H12BrN5/c17-9-4-3-5-10(8-9)19-14-13-11-6-1-2-7-12(11)20-15(13)22-16(18)21-14/h1-8H,(H4,18,19,20,21,22)