N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]piperidin-4-yl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]piperidin-4-yl]-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-4-piperidyl]-1-methyl-pyrazole-4-carboxamide CAS Name: N-[1-[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]-4-piperidinyl]-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[1-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]piperidin-4-yl]-1-methylpyrazole-4-carboxamide Traditional Name: N-[1-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoyl]-4-piperidyl]-1-methyl-pyrazole-4-carboxamide Formula: C20H28N6O2S MolecularWeight: 416.54032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(CC2)NC(=O)C3=CN(N=C3)C

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCC(CC2)NC(=O)C3=CN(N=C3)C

InChI

InChI=1S/C20H28N6O2S/c1-13-17(14(2)23-20(22-13)29-4)5-6-18(27)26-9-7-16(8-10-26)24-19(28)15-11-21-25(3)12-15/h11-12,16H,5-10H2,1-4H3,(H,24,28)