(2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: (2S,3R)-1-butyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: (2S,3R)-1-butyl-2-(2-methoxyphenyl)-6-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: (2S,3R)-1-butyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-6-keto-2-(2-methoxyphenyl)nipecotamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NC2=NN=C(S2)C(C)C)C3=CC=CC=C3OC

Isomeric SMILES

CCCCN1[C@@H]([C@@H](CCC1=O)C(=O)NC2=NN=C(S2)C(C)C)C3=CC=CC=C3OC

InChI

InChI=1S/C22H30N4O3S/c1-5-6-13-26-18(27)12-11-16(19(26)15-9-7-8-10-17(15)29-4)20(28)23-22-25-24-21(30-22)14(2)3/h7-10,14,16,19H,5-6,11-13H2,1-4H3,(H,23,25,28)/t16-,19-/m1/s1