N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[[4-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[[4-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[[4-(5-methylol-2-furyl)phenyl]thiocarbamoyl]-2-(3-methylphenoxy)acetamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)C3=CC=C(O3)CO

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)C3=CC=C(O3)CO

InChI

InChI=1S/C21H20N2O4S/c1-14-3-2-4-17(11-14)26-13-20(25)23-21(28)22-16-7-5-15(6-8-16)19-10-9-18(12-24)27-19/h2-11,24H,12-13H2,1H3,(H2,22,23,25,28)