N-[[(3S)-1-(2,6-dimethylpyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]furan-2-carboxamide

Systemtic Name: N-[[(3S)-1-(2,6-dimethylpyrimidin-4-yl)carbonylpiperidin-3-yl]methyl]furan-2-carboxamide Openeye Name: N-[[(3S)-1-(2,6-dimethylpyrimidine-4-carbonyl)-3-piperidyl]methyl]furan-2-carboxamide CAS Name: N-[[(3S)-1-[(2,6-dimethyl-4-pyrimidinyl)-oxomethyl]-3-piperidinyl]methyl]-2-furancarboxamide IUPAC Name: N-[[(3S)-1-(2,6-dimethylpyrimidine-4-carbonyl)piperidin-3-yl]methyl]furan-2-carboxamide Traditional Name: N-[[(3S)-1-(2,6-dimethylpyrimidine-4-carbonyl)-3-piperidyl]methyl]-2-furamide Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N2CCCC(C2)CNC(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N2CCC[C@H](C2)CNC(=O)C3=CC=CO3)C

InChI

InChI=1S/C18H22N4O3/c1-12-9-15(21-13(2)20-12)18(24)22-7-3-5-14(11-22)10-19-17(23)16-6-4-8-25-16/h4,6,8-9,14H,3,5,7,10-11H2,1-2H3,(H,19,23)/t14-/m0/s1