cyclohexyl 4-[2-(2-propan-2-ylphenoxy)ethanoylcarbamothioylamino]benzoate

Systemtic Name: cyclohexyl 4-[2-(2-propan-2-ylphenoxy)ethanoylcarbamothioylamino]benzoate Openeye Name: cyclohexyl 4-[[2-(2-isopropylphenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]amino]-sulfanylidenemethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[2-(2-propan-2-ylphenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(2-isopropylphenoxy)acetyl]thiocarbamoylamino]benzoic acid cyclohexyl ester Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC3CCCCC3

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC3CCCCC3

InChI

InChI=1S/C25H30N2O4S/c1-17(2)21-10-6-7-11-22(21)30-16-23(28)27-25(32)26-19-14-12-18(13-15-19)24(29)31-20-8-4-3-5-9-20/h6-7,10-15,17,20H,3-5,8-9,16H2,1-2H3,(H2,26,27,28,32)