6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-[(4-methylsulfonylphenyl)methyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-[(4-methylsulfonylphenyl)methyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-[(4-methylsulfonylphenyl)methyl]-1H-pyrimidine-2,4-dione CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-[(4-methylsulfonylphenyl)methyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-5-[(4-methylsulfonylphenyl)methyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(4-mesylbenzyl)-3-methyl-uracil Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(NC1=O)N2CCC3=CC=CC=C3C2)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C(=C(NC1=O)N2CCC3=CC=CC=C3C2)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H23N3O4S/c1-24-21(26)19(13-15-7-9-18(10-8-15)30(2,28)29)20(23-22(24)27)25-12-11-16-5-3-4-6-17(16)14-25/h3-10H,11-14H2,1-2H3,(H,23,27)