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

Systemtic Name: 6-(4-chlorophenyl)-2-cyclopropyl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Openeye Name: 6-(4-chlorophenyl)-2-cyclopropyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]quinazolin-4-one CAS Name: 6-(4-chlorophenyl)-2-cyclopropyl-3-[[(3S)-1-propan-2-yl-3-piperidinyl]methyl]-4-quinazolinone IUPAC Name: 6-(4-chlorophenyl)-2-cyclopropyl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Traditional Name: 6-(4-chlorophenyl)-2-cyclopropyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]quinazolin-4-one Formula: C26H30ClN3O MolecularWeight: 435.9889

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCCC(C1)CN2C(=NC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)Cl)C5CC5

Isomeric SMILES

CC(C)N1CCC[C@@H](C1)CN2C(=NC3=C(C2=O)C=C(C=C3)C4=CC=C(C=C4)Cl)C5CC5

InChI

InChI=1S/C26H30ClN3O/c1-17(2)29-13-3-4-18(15-29)16-30-25(20-5-6-20)28-24-12-9-21(14-23(24)26(30)31)19-7-10-22(27)11-8-19/h7-12,14,17-18,20H,3-6,13,15-16H2,1-2H3/t18-/m0/s1