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

Systemtic Name: butyl 4-(1-benzofuran-2-ylcarbonylcarbamothioylamino)benzoate Openeye Name: butyl 4-(benzofuran-2-carbonylcarbamothioylamino)benzoate CAS Name: 4-[[[[2-benzofuranyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(1-benzofuran-2-carbonylcarbamothioylamino)benzoate Traditional Name: 4-(benzofuran-2-carbonylthiocarbamoylamino)benzoic acid butyl ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C21H20N2O4S/c1-2-3-12-26-20(25)14-8-10-16(11-9-14)22-21(28)23-19(24)18-13-15-6-4-5-7-17(15)27-18/h4-11,13H,2-3,12H2,1H3,(H2,22,23,24,28)