6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one

Systemtic Name: 6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Openeye Name: 6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]quinazolin-4-one CAS Name: 6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-propan-2-yl-3-piperidinyl]methyl]-4-quinazolinone IUPAC Name: 6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Traditional Name: 6-(4-chlorophenyl)-2-ethyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]quinazolin-4-one Formula: C25H30ClN3O MolecularWeight: 423.9782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)N1CC4CCCN(C4)C(C)C

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)N1C[C@H]4CCCN(C4)C(C)C

InChI

InChI=1S/C25H30ClN3O/c1-4-24-27-23-12-9-20(19-7-10-21(26)11-8-19)14-22(23)25(30)29(24)16-18-6-5-13-28(15-18)17(2)3/h7-12,14,17-18H,4-6,13,15-16H2,1-3H3/t18-/m0/s1