2-methoxyethyl (E)-3-[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-3-[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]-2-cyano-prop-2-enoate Openeye Name: 2-methoxyethyl (E)-3-[4-bromo-5-(4-chlorophenyl)sulfanyl-2-furyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-bromo-5-[(4-chlorophenyl)thio]-2-furanyl]-2-cyano-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-3-[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-bromo-5-[(4-chlorophenyl)thio]-2-furyl]-2-cyano-acrylic acid 2-methoxyethyl ester Formula: C17H13BrClNO4S MolecularWeight: 442.71142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrClNO4S/c1-22-6-7-23-16(21)11(10-20)8-13-9-15(18)17(24-13)25-14-4-2-12(19)3-5-14/h2-5,8-9H,6-7H2,1H3/b11-8+