2-[4-[4-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylic acid

Systemtic Name: 2-[4-[4-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylic acid Openeye Name: 2-[4-[4-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylic acid CAS Name: 2-[oxo-[4-[4-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]phenyl]phenyl]methyl]-1-cyclopentanecarboxylic acid IUPAC Name: 2-[4-[4-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentane-1-carboxylic acid Traditional Name: 2-[4-[4-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylic acid Formula: C29H28N2O3S MolecularWeight: 484.60922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(S2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)O

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(S2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)O

InChI

InChI=1S/C29H28N2O3S/c1-17(2)21-12-15-25-26(16-21)35-29(31-25)30-22-13-10-19(11-14-22)18-6-8-20(9-7-18)27(32)23-4-3-5-24(23)28(33)34/h6-17,23-24H,3-5H2,1-2H3,(H,30,31)(H,33,34)