(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(2-pyridyl)thiazol-4-yl]methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid [2-(2-pyridinyl)-4-thiazolyl]methyl ester IUPAC Name: (2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid [2-(2-pyridyl)thiazol-4-yl]methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=N3)NC(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)C3=CC=CC=N3)NC(=O)C4CCCCC4)OC

InChI

InChI=1S/C25H27N3O5S/c1-31-21-12-18(20(13-22(21)32-2)28-23(29)16-8-4-3-5-9-16)25(30)33-14-17-15-34-24(27-17)19-10-6-7-11-26-19/h6-7,10-13,15-16H,3-5,8-9,14H2,1-2H3,(H,28,29)