9-chloranyl-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine

Systemtic Name: 9-chloranyl-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine Openeye Name: 9-chloro-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine CAS Name: 9-chloro-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine IUPAC Name: 9-chloro-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine Traditional Name: 9-chloro-7-(2-fluorophenyl)-1-methoxy-3-methyl-5H-pyrimido[4,5-d][2]benzazepine Formula: C20H15ClFN3O MolecularWeight: 367.804003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F)C(=N1)OC

Isomeric SMILES

CC1=NC2=C(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F)C(=N1)OC

InChI

InChI=1S/C20H15ClFN3O/c1-11-24-17-10-23-19(14-5-3-4-6-16(14)22)15-9-12(21)7-8-13(15)18(17)20(25-11)26-2/h3-9H,10H2,1-2H3