(E)-3-(2,4-dichlorophenyl)-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2,4-dichlorophenyl)-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2,4-dichlorophenyl)-N-[(2-hydroxy-4-methyl-phenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2,4-dichlorophenyl)-N-[(2-hydroxy-4-methylanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2,4-dichlorophenyl)-N-[(2-hydroxy-4-methylphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2,4-dichlorophenyl)-N-[(2-hydroxy-4-methyl-phenyl)thiocarbamoyl]acrylamide Formula: C17H14Cl2N2O2S MolecularWeight: 381.27626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(=O)C=CC2=C(C=C(C=C2)Cl)Cl)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C17H14Cl2N2O2S/c1-10-2-6-14(15(22)8-10)20-17(24)21-16(23)7-4-11-3-5-12(18)9-13(11)19/h2-9,22H,1H3,(H2,20,21,23,24)/b7-4+