7-chloranyl-2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one Formula: C21H24ClN3O MolecularWeight: 369.88776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3O/c1-4-14-5-7-15(8-6-14)20(13(2)3)23-12-19-24-18-11-16(22)9-10-17(18)21(26)25-19/h5-11,13,20,23H,4,12H2,1-3H3,(H,24,25,26)/t20-/m0/s1