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

Systemtic Name: 6-(3-methylphenoxy)-2-propan-2-yl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Openeye Name: 2-isopropyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]-6-(3-methylphenoxy)quinazolin-4-one CAS Name: 6-(3-methylphenoxy)-2-propan-2-yl-3-[[(3S)-1-propan-2-yl-3-piperidinyl]methyl]-4-quinazolinone IUPAC Name: 6-(3-methylphenoxy)-2-propan-2-yl-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Traditional Name: 2-isopropyl-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]-6-(3-methylphenoxy)quinazolin-4-one Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)N=C(N(C3=O)CC4CCCN(C4)C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC3=C(C=C2)N=C(N(C3=O)C[C@H]4CCCN(C4)C(C)C)C(C)C

InChI

InChI=1S/C27H35N3O2/c1-18(2)26-28-25-12-11-23(32-22-10-6-8-20(5)14-22)15-24(25)27(31)30(26)17-21-9-7-13-29(16-21)19(3)4/h6,8,10-12,14-15,18-19,21H,7,9,13,16-17H2,1-5H3/t21-/m0/s1