3-(2,4-dichlorophenyl)-N-[[2-methoxy-5-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(2,4-dichlorophenyl)-N-[[2-methoxy-5-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: 3-(2,4-dichlorophenyl)-N-[[2-methoxy-5-(2-oxochromen-3-yl)phenyl]carbamothioyl]prop-2-enamide CAS Name: 3-(2,4-dichlorophenyl)-N-[[2-methoxy-5-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-(2,4-dichlorophenyl)-N-[[2-methoxy-5-(2-oxochromen-3-yl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: 3-(2,4-dichlorophenyl)-N-[[5-(2-ketochromen-3-yl)-2-methoxy-phenyl]thiocarbamoyl]acrylamide Formula: C26H18Cl2N2O4S MolecularWeight: 525.40312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=S)NC(=O)C=CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)NC(=S)NC(=O)C=CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H18Cl2N2O4S/c1-33-23-10-7-16(19-12-17-4-2-3-5-22(17)34-25(19)32)13-21(23)29-26(35)30-24(31)11-8-15-6-9-18(27)14-20(15)28/h2-14H,1H3,(H2,29,30,31,35)