6-[(3S)-3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]carbonyl-1H-pyrimidine-2,4-dione

Systemtic Name: 6-[(3S)-3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidin-1-yl]carbonyl-1H-pyrimidine-2,4-dione Openeye Name: 6-[(3S)-3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione CAS Name: 6-[[(3S)-3-[2-methyl-5-(3-methylphenyl)-4-pyrimidinyl]-1-piperidinyl]-oxomethyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-[(3S)-3-[2-methyl-5-(3-methylphenyl)pyrimidin-4-yl]piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-[(3S)-3-[2-methyl-5-(m-tolyl)pyrimidin-4-yl]piperidine-1-carbonyl]uracil Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CCCN(C3)C(=O)C4=CC(=O)NC(=O)N4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2[C@H]3CCCN(C3)C(=O)C4=CC(=O)NC(=O)N4)C

InChI

InChI=1S/C22H23N5O3/c1-13-5-3-6-15(9-13)17-11-23-14(2)24-20(17)16-7-4-8-27(12-16)21(29)18-10-19(28)26-22(30)25-18/h3,5-6,9-11,16H,4,7-8,12H2,1-2H3,(H2,25,26,28,30)/t16-/m0/s1