2-[[[(1S)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[(1S)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[(1S)-1-(4-isobutylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[(1S)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[(1S)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[(1S)-1-(4-isobutylphenyl)-2-methyl-propyl]amino]methyl]-1H-quinazolin-4-one Formula: C23H29N3O MolecularWeight: 363.49586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C(C)C)NCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)[C@H](C(C)C)NCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C23H29N3O/c1-15(2)13-17-9-11-18(12-10-17)22(16(3)4)24-14-21-25-20-8-6-5-7-19(20)23(27)26-21/h5-12,15-16,22,24H,13-14H2,1-4H3,(H,25,26,27)/t22-/m0/s1