6-[(6-methylpyridin-3-yl)methyl]-3-[(1S,2S)-2-oxidanylcyclohexyl]benzo[h]quinazolin-4-one

Systemtic Name: 6-[(6-methylpyridin-3-yl)methyl]-3-[(1S,2S)-2-oxidanylcyclohexyl]benzo[h]quinazolin-4-one Openeye Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-[(6-methyl-3-pyridyl)methyl]benzo[h]quinazolin-4-one CAS Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-[(6-methyl-3-pyridinyl)methyl]-4-benzo[h]quinazolinone IUPAC Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-[(6-methylpyridin-3-yl)methyl]benzo[h]quinazolin-4-one Traditional Name: 3-[(1S,2S)-2-hydroxycyclohexyl]-6-[(6-methyl-3-pyridyl)methyl]benzo[h]quinazolin-4-one Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)C5CCCCC5O

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)[C@H]5CCCC[C@@H]5O

InChI

InChI=1S/C25H25N3O2/c1-16-10-11-17(14-26-16)12-18-13-21-24(20-7-3-2-6-19(18)20)27-15-28(25(21)30)22-8-4-5-9-23(22)29/h2-3,6-7,10-11,13-15,22-23,29H,4-5,8-9,12H2,1H3/t22-,23-/m0/s1