3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloranyl-2-phenethyl-quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloranyl-2-phenethyl-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloro-2-phenethyl-quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloro-2-phenethyl-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloro-2-phenethylquinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-chloro-2-phenethyl-quinazolin-4-one Formula: C24H28ClN3O MolecularWeight: 409.95162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CN2C(=NC3=C(C2=O)C=C(C=C3)Cl)CCC4=CC=CC=C4)CN

Isomeric SMILES

C1CC(CC(C1)CN2C(=NC3=C(C2=O)C=C(C=C3)Cl)CCC4=CC=CC=C4)CN

InChI

InChI=1S/C24H28ClN3O/c25-20-10-11-22-21(14-20)24(29)28(16-19-8-4-7-18(13-19)15-26)23(27-22)12-9-17-5-2-1-3-6-17/h1-3,5-6,10-11,14,18-19H,4,7-9,12-13,15-16,26H2