ethyl 4-[2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 4-[[2-[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]thio]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[[4-(cyclohexanecarbonylamino)phenyl]thio]propanoylamino]benzoic acid ethyl ester Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C25H30N2O4S/c1-3-31-25(30)19-9-11-20(12-10-19)26-23(28)17(2)32-22-15-13-21(14-16-22)27-24(29)18-7-5-4-6-8-18/h9-18H,3-8H2,1-2H3,(H,26,28)(H,27,29)