2-azanyl-3-methyl-6-[2-[3-(4-methylsulfonylphenyl)phenyl]ethyl]pyrimidin-4-one

Systemtic Name: 2-azanyl-3-methyl-6-[2-[3-(4-methylsulfonylphenyl)phenyl]ethyl]pyrimidin-4-one Openeye Name: 2-amino-3-methyl-6-[2-[3-(4-methylsulfonylphenyl)phenyl]ethyl]pyrimidin-4-one CAS Name: 2-amino-3-methyl-6-[2-[3-(4-methylsulfonylphenyl)phenyl]ethyl]-4-pyrimidinone IUPAC Name: 2-amino-3-methyl-6-[2-[3-(4-methylsulfonylphenyl)phenyl]ethyl]pyrimidin-4-one Traditional Name: 2-amino-6-[2-[3-(4-mesylphenyl)phenyl]ethyl]-3-methyl-pyrimidin-4-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N)CCC2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C=C(N=C1N)CCC2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H21N3O3S/c1-23-19(24)13-17(22-20(23)21)9-6-14-4-3-5-16(12-14)15-7-10-18(11-8-15)27(2,25)26/h3-5,7-8,10-13H,6,9H2,1-2H3,(H2,21,22)