(E)-N-[4-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]but-2-enamide

Systemtic Name: (E)-N-[4-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]but-2-enamide Openeye Name: (E)-N-[4-[[4-(1H-indol-3-yl)-1-piperidyl]methyl]thiazol-2-yl]but-2-enamide CAS Name: (E)-N-[4-[[4-(1H-indol-3-yl)-1-piperidinyl]methyl]-2-thiazolyl]-2-butenamide IUPAC Name: (E)-N-[4-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]but-2-enamide Traditional Name: (E)-N-[4-[[4-(1H-indol-3-yl)piperidino]methyl]thiazol-2-yl]but-2-enamide Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=NC(=CS1)CN2CCC(CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

C/C=C/C(=O)NC1=NC(=CS1)CN2CCC(CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H24N4OS/c1-2-5-20(26)24-21-23-16(14-27-21)13-25-10-8-15(9-11-25)18-12-22-19-7-4-3-6-17(18)19/h2-7,12,14-15,22H,8-11,13H2,1H3,(H,23,24,26)/b5-2+