(E)-3-[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[4-bromo-5-(4-chlorophenyl)sulfanyl-2-furyl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[4-bromo-5-[(4-chlorophenyl)thio]-2-furanyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[4-bromo-5-[(4-chlorophenyl)thio]-2-furyl]-2-cyano-N-isopropyl-acrylamide Formula: C17H14BrClN2O2S MolecularWeight: 425.72726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(O1)SC2=CC=C(C=C2)Cl)Br)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(O1)SC2=CC=C(C=C2)Cl)Br)/C#N

InChI

InChI=1S/C17H14BrClN2O2S/c1-10(2)21-16(22)11(9-20)7-13-8-15(18)17(23-13)24-14-5-3-12(19)4-6-14/h3-8,10H,1-2H3,(H,21,22)/b11-7+