N-[(1R)-2-(3-methoxyphenyl)-1-[1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-4-yl]ethyl]-N-methyl-furan-2-carboxamide

Systemtic Name: N-[(1R)-2-(3-methoxyphenyl)-1-[1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-4-yl]ethyl]-N-methyl-furan-2-carboxamide Openeye Name: N-[(1R)-2-(3-methoxyphenyl)-1-[1-(2-pyrimidin-2-ylsulfanylacetyl)-4-piperidyl]ethyl]-N-methyl-furan-2-carboxamide CAS Name: N-[(1R)-2-(3-methoxyphenyl)-1-[1-[1-oxo-2-(2-pyrimidinylthio)ethyl]-4-piperidinyl]ethyl]-N-methyl-2-furancarboxamide IUPAC Name: N-[(1R)-2-(3-methoxyphenyl)-1-[1-(2-pyrimidin-2-ylsulfanylacetyl)piperidin-4-yl]ethyl]-N-methylfuran-2-carboxamide Traditional Name: N-[(1R)-2-(3-methoxyphenyl)-1-[1-[2-(2-pyrimidylthio)acetyl]-4-piperidyl]ethyl]-N-methyl-2-furamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC(=CC=C1)OC)C2CCN(CC2)C(=O)CSC3=NC=CC=N3)C(=O)C4=CC=CO4

Isomeric SMILES

CN([C@H](CC1=CC(=CC=C1)OC)C2CCN(CC2)C(=O)CSC3=NC=CC=N3)C(=O)C4=CC=CO4

InChI

InChI=1S/C26H30N4O4S/c1-29(25(32)23-8-4-15-34-23)22(17-19-6-3-7-21(16-19)33-2)20-9-13-30(14-10-20)24(31)18-35-26-27-11-5-12-28-26/h3-8,11-12,15-16,20,22H,9-10,13-14,17-18H2,1-2H3/t22-/m1/s1