7-chloranyl-2-[[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[cyclopropyl-(2,5-dimethoxybenzyl)amino]methyl]-1H-quinazolin-4-one Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4CC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4CC4

InChI

InChI=1S/C21H22ClN3O3/c1-27-16-6-8-19(28-2)13(9-16)11-25(15-4-5-15)12-20-23-18-10-14(22)3-7-17(18)21(26)24-20/h3,6-10,15H,4-5,11-12H2,1-2H3,(H,23,24,26)