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

Systemtic Name: 4-hexyl-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Openeye Name: 4-hexyl-N-[3-(2-pyrrolidin-1-ylthiazol-4-yl)phenyl]benzamide CAS Name: 4-hexyl-N-[3-[2-(1-pyrrolidinyl)-4-thiazolyl]phenyl]benzamide IUPAC Name: 4-hexyl-N-[3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)phenyl]benzamide Traditional Name: 4-hexyl-N-[3-(2-pyrrolidinothiazol-4-yl)phenyl]benzamide Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCC4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)N4CCCC4

InChI

InChI=1S/C26H31N3OS/c1-2-3-4-5-9-20-12-14-21(15-13-20)25(30)27-23-11-8-10-22(18-23)24-19-31-26(28-24)29-16-6-7-17-29/h8,10-15,18-19H,2-7,9,16-17H2,1H3,(H,27,30)