N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: 3-(4-methoxyphenyl)-N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO

Isomeric SMILES

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO

InChI

InChI=1S/C22H20N2O4S/c1-27-18-8-5-15(6-9-18)7-12-21(26)24-22(29)23-17-4-2-3-16(13-17)20-11-10-19(14-25)28-20/h2-13,25H,14H2,1H3,(H2,23,24,26,29)