2-[4-[3-fluoranyl-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylate

Systemtic Name: 2-[4-[3-fluoranyl-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylate Openeye Name: 2-[4-[3-fluoro-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylate CAS Name: 2-[[4-[3-fluoro-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]-oxomethyl]-1-cyclopentanecarboxylate IUPAC Name: 2-[4-[3-fluoro-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentane-1-carboxylate Traditional Name: 2-[4-[3-fluoro-4-[(4-methyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylate Formula: C27H22FN2O3S- MolecularWeight: 473.538583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)[O-])F

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)[O-])F

InChI

InChI=1S/C27H23FN2O3S/c1-15-4-2-7-23-24(15)30-27(34-23)29-22-13-12-18(14-21(22)28)16-8-10-17(11-9-16)25(31)19-5-3-6-20(19)26(32)33/h2,4,7-14,19-20H,3,5-6H2,1H3,(H,29,30)(H,32,33)/p-1