2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Openeye Name: 2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one CAS Name: 2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one IUPAC Name: 2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Traditional Name: 2-(4-fluorophenyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCC2=C(C1)C(=O)N=C(N2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCC2=C(C1)C(=O)N=C(N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H28FN3O3S/c1-2-3-4-5-6-7-14-29(27,28)25-13-12-19-18(15-25)21(26)24-20(23-19)16-8-10-17(22)11-9-16/h8-11H,2-7,12-15H2,1H3,(H,23,24,26)