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

Systemtic Name: 3,5,5-trimethyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]hexanamide Openeye Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-3,5,5-trimethyl-hexanamide CAS Name: 3,5,5-trimethyl-N-[3-[2-(prop-2-enylamino)-4-thiazolyl]phenyl]hexanamide IUPAC Name: 3,5,5-trimethyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]hexanamide Traditional Name: N-[3-[2-(allylamino)thiazol-4-yl]phenyl]-3,5,5-trimethyl-hexanamide Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3OS/c1-6-10-22-20-24-18(14-26-20)16-8-7-9-17(12-16)23-19(25)11-15(2)13-21(3,4)5/h6-9,12,14-15H,1,10-11,13H2,2-5H3,(H,22,24)(H,23,25)