3-[[4-(azepan-1-ylcarbonyl)cyclohexyl]methyl]quinazolin-4-one

Systemtic Name: 3-[[4-(azepan-1-ylcarbonyl)cyclohexyl]methyl]quinazolin-4-one Openeye Name: 3-[[4-(azepane-1-carbonyl)cyclohexyl]methyl]quinazolin-4-one CAS Name: 3-[[4-[1-azepanyl(oxo)methyl]cyclohexyl]methyl]-4-quinazolinone IUPAC Name: 3-[[4-(azepane-1-carbonyl)cyclohexyl]methyl]quinazolin-4-one Traditional Name: 3-[[4-(azepane-1-carbonyl)cyclohexyl]methyl]quinazolin-4-one Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCC(CC2)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCC(CC2)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H29N3O2/c26-21(24-13-5-1-2-6-14-24)18-11-9-17(10-12-18)15-25-16-23-20-8-4-3-7-19(20)22(25)27/h3-4,7-8,16-18H,1-2,5-6,9-15H2