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

Systemtic Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-5-oxidanylidene-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide Openeye Name: (2S,3R)-1-butyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-2-(4-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-5-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-pyrrolidinecarboxamide IUPAC Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-5-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide Traditional Name: (2S,3R)-1-butyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-5-keto-2-(4-methoxyphenyl)pyrrolidine-3-carboxamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CC1=O)C(=O)NC2=NN=C(S2)C(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1[C@@H]([C@@H](CC1=O)C(=O)NC2=NN=C(S2)C(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N4O3S/c1-5-6-11-25-17(26)12-16(18(25)14-7-9-15(28-4)10-8-14)19(27)22-21-24-23-20(29-21)13(2)3/h7-10,13,16,18H,5-6,11-12H2,1-4H3,(H,22,24,27)/t16-,18-/m1/s1