ethyl 3-(4-chlorophenyl)-4-cyano-5-propan-2-ylsulfanyl-furan-2-carboxylate

Systemtic Name: ethyl 3-(4-chlorophenyl)-4-cyano-5-propan-2-ylsulfanyl-furan-2-carboxylate Openeye Name: ethyl 3-(4-chlorophenyl)-4-cyano-5-isopropylsulfanyl-furan-2-carboxylate CAS Name: 3-(4-chlorophenyl)-4-cyano-5-(propan-2-ylthio)-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-4-cyano-5-propan-2-ylsulfanylfuran-2-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-cyano-5-(isopropylthio)furan-2-carboxylic acid ethyl ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(O1)SC(C)C)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(O1)SC(C)C)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClNO3S/c1-4-21-16(20)15-14(11-5-7-12(18)8-6-11)13(9-19)17(22-15)23-10(2)3/h5-8,10H,4H2,1-3H3