2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[cyclopropyl-(4-fluorobenzyl)amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN(CC3=CC=C(C=C3)F)C4CC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN(CC3=CC=C(C=C3)F)C4CC4)OC

InChI

InChI=1S/C21H22FN3O3/c1-27-18-9-16-17(10-19(18)28-2)23-20(24-21(16)26)12-25(15-7-8-15)11-13-3-5-14(22)6-4-13/h3-6,9-10,15H,7-8,11-12H2,1-2H3,(H,23,24,26)