4-[cyclohexylcarbonyl-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)amino]benzoate

Systemtic Name: 4-[cyclohexylcarbonyl-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)amino]benzoate Openeye Name: 4-[cyclohexanecarbonyl-(5-ethyl-4-phenyl-thiazol-2-yl)amino]benzoate CAS Name: 4-[[cyclohexyl(oxo)methyl]-(5-ethyl-4-phenyl-2-thiazolyl)amino]benzoate IUPAC Name: 4-[cyclohexanecarbonyl-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)amino]benzoate Traditional Name: 4-[cyclohexanecarbonyl-(5-ethyl-4-phenyl-thiazol-2-yl)amino]benzoate Formula: C25H25N2O3S- MolecularWeight: 433.5426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)N(C2=CC=C(C=C2)C(=O)[O-])C(=O)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(N=C(S1)N(C2=CC=C(C=C2)C(=O)[O-])C(=O)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S/c1-2-21-22(17-9-5-3-6-10-17)26-25(31-21)27(23(28)18-11-7-4-8-12-18)20-15-13-19(14-16-20)24(29)30/h3,5-6,9-10,13-16,18H,2,4,7-8,11-12H2,1H3,(H,29,30)/p-1