methyl 2-[2-[4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-[4-(4-fluorophenyl)thiazol-2-yl]piperazin-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[4-[4-(4-fluorophenyl)-2-thiazolyl]-1-piperazinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[4-[4-(4-fluorophenyl)thiazol-2-yl]piperazino]acetyl]amino]benzoic acid methyl ester Formula: C23H23FN4O3S MolecularWeight: 454.517123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CN2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O3S/c1-31-22(30)18-4-2-3-5-19(18)25-21(29)14-27-10-12-28(13-11-27)23-26-20(15-32-23)16-6-8-17(24)9-7-16/h2-9,15H,10-14H2,1H3,(H,25,29)