2-[[[(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]amino]methyl]-7-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[[[(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]amino]methyl]-7-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[[(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]amino]methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 2-[[[(1R)-1-(4-tert-butylphenyl)-2-methylpropyl]amino]methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[[(1R)-1-(4-tert-butylphenyl)-2-methylpropyl]amino]methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[[[(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]amino]methyl]-7-chloro-1H-quinazolin-4-one Formula: C23H28ClN3O MolecularWeight: 397.94092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClN3O/c1-14(2)21(15-6-8-16(9-7-15)23(3,4)5)25-13-20-26-19-12-17(24)10-11-18(19)22(28)27-20/h6-12,14,21,25H,13H2,1-5H3,(H,26,27,28)/t21-/m1/s1