2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione

Systemtic Name: 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione Openeye Name: 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanyl-1,3-bis(1-piperidyl)propane-1,3-dione CAS Name: 2-[[4-(4-chlorophenyl)-6-methyl-2-pyrimidinyl]thio]-1,3-bis(1-piperidinyl)propane-1,3-dione IUPAC Name: 2-[4-(4-chlorophenyl)-6-methylpyrimidin-2-yl]sulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione Traditional Name: 2-[[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]thio]-1,3-dipiperidino-propane-1,3-dione Formula: C24H29ClN4O2S MolecularWeight: 473.03066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SC(C(=O)N3CCCCC3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SC(C(=O)N3CCCCC3)C(=O)N4CCCCC4

InChI

InChI=1S/C24H29ClN4O2S/c1-17-16-20(18-8-10-19(25)11-9-18)27-24(26-17)32-21(22(30)28-12-4-2-5-13-28)23(31)29-14-6-3-7-15-29/h8-11,16,21H,2-7,12-15H2,1H3