(E)-N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[(3-bromanyl-4-methyl-phenyl)carbonylamino]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[(3-bromo-4-methyl-benzoyl)amino]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[[(3-bromo-4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[(3-bromo-4-methyl-benzoyl)amino]thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C16H14BrN3O2S2 MolecularWeight: 424.33526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C=CC2=CC=CS2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CS2)Br

InChI

InChI=1S/C16H14BrN3O2S2/c1-10-4-5-11(9-13(10)17)15(22)19-20-16(23)18-14(21)7-6-12-3-2-8-24-12/h2-9H,1H3,(H,19,22)(H2,18,20,21,23)/b7-6+