cyclohexyl 4-(1-benzofuran-2-ylcarbonylcarbamothioylamino)benzoate

Systemtic Name: cyclohexyl 4-(1-benzofuran-2-ylcarbonylcarbamothioylamino)benzoate Openeye Name: cyclohexyl 4-(benzofuran-2-carbonylcarbamothioylamino)benzoate CAS Name: 4-[[[[2-benzofuranyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-(1-benzofuran-2-carbonylcarbamothioylamino)benzoate Traditional Name: 4-(benzofuran-2-carbonylthiocarbamoylamino)benzoic acid cyclohexyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H22N2O4S/c26-21(20-14-16-6-4-5-9-19(16)29-20)25-23(30)24-17-12-10-15(11-13-17)22(27)28-18-7-2-1-3-8-18/h4-6,9-14,18H,1-3,7-8H2,(H2,24,25,26,30)