N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]octanamide

Systemtic Name: N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]octanamide Openeye Name: N-[3-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]octanamide CAS Name: N-[3-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]octanamide IUPAC Name: N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]octanamide Traditional Name: N-[3-(2-pyrrolidinothiazol-4-yl)phenyl]caprylamide Formula: C21H29N3OS MolecularWeight: 371.53946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3OS/c1-2-3-4-5-6-12-20(25)22-18-11-9-10-17(15-18)19-16-26-21(23-19)24-13-7-8-14-24/h9-11,15-16H,2-8,12-14H2,1H3,(H,22,25)