(E)-N-[(5-bromanyl-2-oxidanyl-phenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(5-bromanyl-2-oxidanyl-phenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[(5-bromo-2-hydroxy-phenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[(5-bromo-2-hydroxyanilino)-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[(5-bromo-2-hydroxyphenyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[(5-bromo-2-hydroxy-phenyl)thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C17H15BrN2O3S MolecularWeight: 407.2816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O3S/c1-23-13-6-2-11(3-7-13)4-9-16(22)20-17(24)19-14-10-12(18)5-8-15(14)21/h2-10,21H,1H3,(H2,19,20,22,24)/b9-4+