7-azanylidene-6-(2-bromanyl-6-chloranyl-phenyl)-8-ethyl-N-phenyl-pyrido[2,3-d]pyrimidin-8-ium-8-amine

Systemtic Name: 7-azanylidene-6-(2-bromanyl-6-chloranyl-phenyl)-8-ethyl-N-phenyl-pyrido[2,3-d]pyrimidin-8-ium-8-amine Openeye Name: 6-(2-bromo-6-chloro-phenyl)-8-ethyl-7-imino-N-phenyl-pyrido[2,3-d]pyrimidin-8-ium-8-amine CAS Name: 6-(2-bromo-6-chlorophenyl)-8-ethyl-7-imino-N-phenyl-8-pyrido[2,3-d]pyrimidin-8-iumamine IUPAC Name: 6-(2-bromo-6-chlorophenyl)-8-ethyl-7-imino-N-phenylpyrido[2,3-d]pyrimidin-8-ium-8-amine Traditional Name: [6-(2-bromo-6-chloro-phenyl)-8-ethyl-7-imino-pyrido[2,3-d]pyrimidin-8-ium-8-yl]-phenyl-amine Formula: C21H18BrClN5+ MolecularWeight: 455.75812

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=N)C(=CC2=CN=CN=C21)C3=C(C=CC=C3Br)Cl)NC4=CC=CC=C4

Isomeric SMILES

CC[N+]1(C(=N)C(=CC2=CN=CN=C21)C3=C(C=CC=C3Br)Cl)NC4=CC=CC=C4

InChI

InChI=1S/C21H18BrClN5/c1-2-28(27-15-7-4-3-5-8-15)20(24)16(11-14-12-25-13-26-21(14)28)19-17(22)9-6-10-18(19)23/h3-13,24,27H,2H2,1H3/q+1