4-butyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]benzamide

Systemtic Name: 4-butyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]benzamide Openeye Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-4-butyl-benzamide CAS Name: 4-butyl-N-[3-[2-(prop-2-enylamino)-4-thiazolyl]phenyl]benzamide IUPAC Name: 4-butyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]benzamide Traditional Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-4-butyl-benzamide Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)NCC=C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=CSC(=N3)NCC=C

InChI

InChI=1S/C23H25N3OS/c1-3-5-7-17-10-12-18(13-11-17)22(27)25-20-9-6-8-19(15-20)21-16-28-23(26-21)24-14-4-2/h4,6,8-13,15-16H,2-3,5,7,14H2,1H3,(H,24,26)(H,25,27)