ethyl 4-[2-[3-(cyclohexylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(cyclohexylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-(cyclohexanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[3-[[cyclohexyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(cyclohexanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[3-(cyclohexanecarbonylamino)phenyl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C24H28N2O4S/c1-2-30-24(29)18-11-13-19(14-12-18)25-22(27)16-31-21-10-6-9-20(15-21)26-23(28)17-7-4-3-5-8-17/h6,9-15,17H,2-5,7-8,16H2,1H3,(H,25,27)(H,26,28)