3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloranyl-2-[(E)-2-phenylethenyl]quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloranyl-2-[(E)-2-phenylethenyl]quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-[(E)-styryl]quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-[(E)-2-phenylethenyl]-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-[(E)-2-phenylethenyl]quinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-7-chloro-2-[(E)-styryl]quinazolin-4-one Formula: C24H26ClN3O MolecularWeight: 407.93574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CN2C(=NC3=C(C2=O)C=CC(=C3)Cl)C=CC4=CC=CC=C4)CN

Isomeric SMILES

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

InChI

InChI=1S/C24H26ClN3O/c25-20-10-11-21-22(14-20)27-23(12-9-17-5-2-1-3-6-17)28(24(21)29)16-19-8-4-7-18(13-19)15-26/h1-3,5-6,9-12,14,18-19H,4,7-8,13,15-16,26H2/b12-9+