N-[4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxyphenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methoxy-4-(pivaloylthiocarbamoylamino)phenyl]coumarilamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3O2)OC

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3O2)OC

InChI

InChI=1S/C22H23N3O4S/c1-22(2,3)20(27)25-21(30)23-14-9-10-15(17(12-14)28-4)24-19(26)18-11-13-7-5-6-8-16(13)29-18/h5-12H,1-4H3,(H,24,26)(H2,23,25,27,30)