(E)-N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(5-bromanyl-6-methyl-pyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[(5-bromo-6-methyl-2-pyridyl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[(5-bromo-6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[(5-bromo-6-methyl-2-pyridyl)thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C17H16BrN3O2S MolecularWeight: 406.29684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C17H16BrN3O2S/c1-11-14(18)8-9-15(19-11)20-17(24)21-16(22)10-5-12-3-6-13(23-2)7-4-12/h3-10H,1-2H3,(H2,19,20,21,22,24)/b10-5+