(2S)-N-[4-[2-(4-propan-2-yloxyphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-[2-(4-propan-2-yloxyphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[3-[2-(4-isopropoxyphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-[2-(4-propan-2-yloxyphenoxy)-5-thiazolyl]but-3-yn-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[4-[2-(4-propan-2-yloxyphenoxy)-1,3-thiazol-5-yl]but-3-yn-2-yl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[3-[2-(4-isopropoxyphenoxy)thiazol-5-yl]-1-methyl-prop-2-ynyl]pyrrolidine-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)OC2=NC=C(S2)C#CC(C)NC(=O)C3CCCN3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)OC2=NC=C(S2)C#CC(C)NC(=O)[C@@H]3CCCN3

InChI

InChI=1S/C21H25N3O3S/c1-14(2)26-16-7-9-17(10-8-16)27-21-23-13-18(28-21)11-6-15(3)24-20(25)19-5-4-12-22-19/h7-10,13-15,19,22H,4-5,12H2,1-3H3,(H,24,25)/t15?,19-/m0/s1