6-[(2S)-2-ethylhexanoyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 6-[(2S)-2-ethylhexanoyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Openeye Name: 6-[(2S)-2-ethylhexanoyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one CAS Name: 6-[(2S)-2-ethyl-1-oxohexyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one IUPAC Name: 6-[(2S)-2-ethylhexanoyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Traditional Name: 6-[(2S)-2-ethylhexanoyl]-2-phenyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCC2=C(C1)C(=O)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

CCCC[C@H](CC)C(=O)N1CCC2=C(C1)C(=O)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-3-5-9-15(4-2)21(26)24-13-12-18-17(14-24)20(25)23-19(22-18)16-10-7-6-8-11-16/h6-8,10-11,15H,3-5,9,12-14H2,1-2H3,(H,22,23,25)/t15-/m0/s1