N-[4-[2-(3-methylphenoxy)ethanoylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[2-(3-methylphenoxy)ethanoylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[2-(3-methylphenoxy)acetyl]carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[[2-(3-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[2-(3-methylphenoxy)acetyl]carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[2-(3-methylphenoxy)acetyl]thiocarbamoylamino]phenyl]-2-furamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H19N3O4S/c1-14-4-2-5-17(12-14)28-13-19(25)24-21(29)23-16-9-7-15(8-10-16)22-20(26)18-6-3-11-27-18/h2-12H,13H2,1H3,(H,22,26)(H2,23,24,25,29)