(3S)-3,5,5-trimethyl-N-[4-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]hexanamide

Systemtic Name: (3S)-3,5,5-trimethyl-N-[4-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]hexanamide Openeye Name: (3S)-3,5,5-trimethyl-N-[4-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]hexanamide CAS Name: (3S)-3,5,5-trimethyl-N-[4-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]hexanamide IUPAC Name: (3S)-3,5,5-trimethyl-N-[4-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]hexanamide Traditional Name: (3S)-3,5,5-trimethyl-N-[4-(2-pyrrolidinothiazol-4-yl)phenyl]hexanamide Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)N3CCCC3)CC(C)(C)C

Isomeric SMILES

C[C@H](CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)N3CCCC3)CC(C)(C)C

InChI

InChI=1S/C22H31N3OS/c1-16(14-22(2,3)4)13-20(26)23-18-9-7-17(8-10-18)19-15-27-21(24-19)25-11-5-6-12-25/h7-10,15-16H,5-6,11-14H2,1-4H3,(H,23,26)/t16-/m1/s1