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

Systemtic Name: (E)-3-(4-chlorophenyl)-N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]acrylamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3O3S/c22-17-6-1-15(2-7-17)3-10-19(26)24-21(29)23-18-8-4-16(5-9-18)20(27)25-11-13-28-14-12-25/h1-10H,11-14H2,(H2,23,24,26,29)/b10-3+