4-chloranyl-8-fluoranyl-11-methyl-6-phenyl-pyrimido[4,5-b][1,4]benzodiazepine

Systemtic Name: 4-chloranyl-8-fluoranyl-11-methyl-6-phenyl-pyrimido[4,5-b][1,4]benzodiazepine Openeye Name: 4-chloro-8-fluoro-11-methyl-6-phenyl-pyrimido[4,5-b][1,4]benzodiazepine CAS Name: 4-chloro-8-fluoro-11-methyl-6-phenylpyrimido[4,5-b][1,4]benzodiazepine IUPAC Name: 4-chloro-8-fluoro-11-methyl-6-phenylpyrimido[4,5-b][1,4]benzodiazepine Traditional Name: 4-chloro-8-fluoro-11-methyl-6-phenyl-pyrimido[4,5-b][1,4]benzodiazepine Formula: C18H12ClFN4 MolecularWeight: 338.766083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)F)C(=NC3=C1N=CN=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)F)C(=NC3=C1N=CN=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C18H12ClFN4/c1-24-14-8-7-12(20)9-13(14)15(11-5-3-2-4-6-11)23-16-17(19)21-10-22-18(16)24/h2-10H,1H3