(2R,3S)-1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: (2R,3S)-1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide Openeye Name: (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenyl-N-thiazol-2-yl-piperidine-3-carboxamide CAS Name: (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenyl-N-(2-thiazolyl)-3-piperidinecarboxamide IUPAC Name: (2R,3S)-1-(4-methoxyphenyl)-6-oxo-2-phenyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide Traditional Name: (2R,3S)-6-keto-1-(4-methoxyphenyl)-2-phenyl-N-thiazol-2-yl-nipecotamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=NC=CS3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@H]([C@H](CCC2=O)C(=O)NC3=NC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-28-17-9-7-16(8-10-17)25-19(26)12-11-18(20(25)15-5-3-2-4-6-15)21(27)24-22-23-13-14-29-22/h2-10,13-14,18,20H,11-12H2,1H3,(H,23,24,27)/t18-,20-/m0/s1