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

Systemtic Name: 6-phenethyl-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-phenethyl-quinazolin-4-one CAS Name: 6-phenethyl-2-propan-2-yl-3-[[(3S)-1-propan-2-yl-3-piperidinyl]methyl]-4-quinazolinone IUPAC Name: 6-phenethyl-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-phenethyl-quinazolin-4-one Formula: C28H37N3O MolecularWeight: 431.61288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C(C=C2)CCC3=CC=CC=C3)C(=O)N1CC4CCCN(C4)C(C)C

Isomeric SMILES

CC(C)C1=NC2=C(C=C(C=C2)CCC3=CC=CC=C3)C(=O)N1C[C@H]4CCCN(C4)C(C)C

InChI

InChI=1S/C28H37N3O/c1-20(2)27-29-26-15-14-23(13-12-22-9-6-5-7-10-22)17-25(26)28(32)31(27)19-24-11-8-16-30(18-24)21(3)4/h5-7,9-10,14-15,17,20-21,24H,8,11-13,16,18-19H2,1-4H3/t24-/m0/s1