2-[[[(1S)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]amino]methyl]-7-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[[[(1S)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]amino]methyl]-7-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[[(1S)-1-(3-bromo-4-methoxy-phenyl)ethyl]amino]methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 2-[[[(1S)-1-(3-bromo-4-methoxyphenyl)ethyl]amino]methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[[(1S)-1-(3-bromo-4-methoxyphenyl)ethyl]amino]methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[[[(1S)-1-(3-bromo-4-methoxy-phenyl)ethyl]amino]methyl]-7-chloro-1H-quinazolin-4-one Formula: C18H17BrClN3O2 MolecularWeight: 422.70348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)OC)Br)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C18H17BrClN3O2/c1-10(11-3-6-16(25-2)14(19)7-11)21-9-17-22-15-8-12(20)4-5-13(15)18(24)23-17/h3-8,10,21H,9H2,1-2H3,(H,22,23,24)/t10-/m0/s1