6-(3-imidazol-1-ylpropylamino)-3-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrimidine-2,4-dione

Systemtic Name: 6-(3-imidazol-1-ylpropylamino)-3-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrimidine-2,4-dione Openeye Name: 6-(3-imidazol-1-ylpropylamino)-3-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrimidine-2,4-dione CAS Name: 6-[3-(1-imidazolyl)propylamino]-3-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrimidine-2,4-dione IUPAC Name: 6-(3-imidazol-1-ylpropylamino)-3-methyl-1-[(4-methylsulfonylphenyl)methyl]pyrimidine-2,4-dione Traditional Name: 6-(3-imidazol-1-ylpropylamino)-1-(4-mesylbenzyl)-3-methyl-pyrimidine-2,4-quinone Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N(C1=O)CC2=CC=C(C=C2)S(=O)(=O)C)NCCCN3C=CN=C3

Isomeric SMILES

CN1C(=O)C=C(N(C1=O)CC2=CC=C(C=C2)S(=O)(=O)C)NCCCN3C=CN=C3

InChI

InChI=1S/C19H23N5O4S/c1-22-18(25)12-17(21-8-3-10-23-11-9-20-14-23)24(19(22)26)13-15-4-6-16(7-5-15)29(2,27)28/h4-7,9,11-12,14,21H,3,8,10,13H2,1-2H3