(E)-N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: (E)-N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]carbamothioyl]-3-(2-furyl)prop-2-enamide CAS Name: (E)-N-[[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-(2-furanyl)-2-propenamide IUPAC Name: (E)-N-[[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: (E)-N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]thiocarbamoyl]-3-(2-furyl)acrylamide Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C=CC2=CC=CO2)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)/C=C/C2=CC=CO2)Br

InChI

InChI=1S/C19H20BrN3O4S/c1-12(2)13-5-7-16(15(20)10-13)27-11-18(25)22-23-19(28)21-17(24)8-6-14-4-3-9-26-14/h3-10,12H,11H2,1-2H3,(H,22,25)(H2,21,23,24,28)/b8-6+