2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NCC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NCC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C23H29N3O3/c1-6-15-7-9-16(10-8-15)22(14(2)3)24-13-21-25-18-12-20(29-5)19(28-4)11-17(18)23(27)26-21/h7-12,14,22,24H,6,13H2,1-5H3,(H,25,26,27)/t22-/m0/s1