3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(1-benzofuran-5-yl)-7-chloranyl-quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(1-benzofuran-5-yl)-7-chloranyl-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(benzofuran-5-yl)-7-chloro-quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(5-benzofuranyl)-7-chloro-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(1-benzofuran-5-yl)-7-chloroquinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(benzofuran-5-yl)-7-chloro-quinazolin-4-one Formula: C24H24ClN3O2 MolecularWeight: 421.91926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CN2C(=NC3=C(C2=O)C=CC(=C3)Cl)C4=CC5=C(C=C4)OC=C5)CN

Isomeric SMILES

C1CC(CC(C1)CN2C(=NC3=C(C2=O)C=CC(=C3)Cl)C4=CC5=C(C=C4)OC=C5)CN

InChI

InChI=1S/C24H24ClN3O2/c25-19-5-6-20-21(12-19)27-23(18-4-7-22-17(11-18)8-9-30-22)28(24(20)29)14-16-3-1-2-15(10-16)13-26/h4-9,11-12,15-16H,1-3,10,13-14,26H2