N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(furan-2-ylcarbonyl)piperidine-3-carboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(furan-2-ylcarbonyl)piperidine-3-carboxamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(furan-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-1-[2-furanyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(furan-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-1-(2-furoyl)nipecotamide Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CO4)C

InChI

InChI=1S/C23H24N4O3S/c1-15-13-16(2)25-23(24-15)31-19-9-7-18(8-10-19)26-21(28)17-5-3-11-27(14-17)22(29)20-6-4-12-30-20/h4,6-10,12-13,17H,3,5,11,14H2,1-2H3,(H,26,28)