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

Systemtic Name: 2-[(3-methylphenyl)methyl]-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Openeye Name: 2-(m-tolylmethyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one CAS Name: 2-[(3-methylphenyl)methyl]-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one IUPAC Name: 2-[(3-methylphenyl)methyl]-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Traditional Name: 2-(3-methylbenzyl)-6-octylsulfonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCC2=C(C1)C(=O)N=C(N2)CC3=CC=CC(=C3)C

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCC2=C(C1)C(=O)N=C(N2)CC3=CC=CC(=C3)C

InChI

InChI=1S/C23H33N3O3S/c1-3-4-5-6-7-8-14-30(28,29)26-13-12-21-20(17-26)23(27)25-22(24-21)16-19-11-9-10-18(2)15-19/h9-11,15H,3-8,12-14,16-17H2,1-2H3,(H,24,25,27)