2-[[ethyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-(2-hydroxy-5-isopropyl-4-methyl-benzyl)amino]methyl]-1H-quinazolin-4-one Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=C(C(=C1)C(C)C)C)O)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCN(CC1=C(C=C(C(=C1)C(C)C)C)O)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H27N3O2/c1-5-25(12-16-11-18(14(2)3)15(4)10-20(16)26)13-21-23-19-9-7-6-8-17(19)22(27)24-21/h6-11,14,26H,5,12-13H2,1-4H3,(H,23,24,27)