(E)-3-(4-methoxyphenyl)-N-[(3-morpholin-4-ylcarbonylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[(3-morpholin-4-ylcarbonylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[3-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-[[3-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C22H23N3O4S/c1-28-19-8-5-16(6-9-19)7-10-20(26)24-22(30)23-18-4-2-3-17(15-18)21(27)25-11-13-29-14-12-25/h2-10,15H,11-14H2,1H3,(H2,23,24,26,30)/b10-7+