N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: N-[(5-bromanylpyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: N-[(5-bromo-2-pyridyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: N-[[(5-bromo-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: N-[(5-bromopyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: N-[(5-bromo-2-pyridyl)thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O2S/c1-22-13-6-2-11(3-7-13)4-9-15(21)20-16(23)19-14-8-5-12(17)10-18-14/h2-10H,1H3,(H2,18,19,20,21,23)