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

Systemtic Name: 3-methyl-5-[(4-methylsulfonylphenyl)methyl]-6-pyrrolidin-1-yl-1H-pyrimidine-2,4-dione Openeye Name: 3-methyl-5-[(4-methylsulfonylphenyl)methyl]-6-pyrrolidin-1-yl-1H-pyrimidine-2,4-dione CAS Name: 3-methyl-5-[(4-methylsulfonylphenyl)methyl]-6-(1-pyrrolidinyl)-1H-pyrimidine-2,4-dione IUPAC Name: 3-methyl-5-[(4-methylsulfonylphenyl)methyl]-6-pyrrolidin-1-yl-1H-pyrimidine-2,4-dione Traditional Name: 5-(4-mesylbenzyl)-3-methyl-6-pyrrolidino-uracil Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(NC1=O)N2CCCC2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C(=C(NC1=O)N2CCCC2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H21N3O4S/c1-19-16(21)14(15(18-17(19)22)20-9-3-4-10-20)11-12-5-7-13(8-6-12)25(2,23)24/h5-8H,3-4,9-11H2,1-2H3,(H,18,22)