(2R,3S)-N-(furan-2-ylmethyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: (2R,3S)-N-(furan-2-ylmethyl)-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: (2R,3S)-N-(2-furylmethyl)-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: (2R,3S)-N-(2-furanylmethyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: (2R,3S)-N-(furan-2-ylmethyl)-1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: (2R,3S)-N-(2-furfuryl)-6-keto-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC3=CC=CO3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@H]([C@H](CCC2=O)C(=O)NCC3=CC=CO3)C4=CC=CS4

InChI

InChI=1S/C22H22N2O3S/c1-15-6-8-16(9-7-15)24-20(25)11-10-18(21(24)19-5-3-13-28-19)22(26)23-14-17-4-2-12-27-17/h2-9,12-13,18,21H,10-11,14H2,1H3,(H,23,26)/t18-,21+/m0/s1