cyclohexyl 4-(4-phenoxybutanoylcarbamothioylamino)benzoate

Systemtic Name: cyclohexyl 4-(4-phenoxybutanoylcarbamothioylamino)benzoate Openeye Name: cyclohexyl 4-(4-phenoxybutanoylcarbamothioylamino)benzoate CAS Name: 4-[[[(1-oxo-4-phenoxybutyl)amino]-sulfanylidenemethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-(4-phenoxybutanoylcarbamothioylamino)benzoate Traditional Name: 4-(4-phenoxybutanoylthiocarbamoylamino)benzoic acid cyclohexyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4S/c27-22(12-7-17-29-20-8-3-1-4-9-20)26-24(31)25-19-15-13-18(14-16-19)23(28)30-21-10-5-2-6-11-21/h1,3-4,8-9,13-16,21H,2,5-7,10-12,17H2,(H2,25,26,27,31)