ethyl 2-[[7-chloranyl-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]-2-methyl-propanoate

Systemtic Name: ethyl 2-[[7-chloranyl-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]-2-methyl-propanoate Openeye Name: ethyl 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]-2-methyl-propanoate CAS Name: 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]-2-methylpropanoate Traditional Name: 2-[[7-chloro-3-(2-fluorophenyl)indoxazen-6-yl]thio]-2-methyl-propionic acid ethyl ester Formula: C19H17ClFNO3S MolecularWeight: 393.859583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)SC1=C(C2=C(C=C1)C(=NO2)C3=CC=CC=C3F)Cl

Isomeric SMILES

CCOC(=O)C(C)(C)SC1=C(C2=C(C=C1)C(=NO2)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C19H17ClFNO3S/c1-4-24-18(23)19(2,3)26-14-10-9-12-16(22-25-17(12)15(14)20)11-7-5-6-8-13(11)21/h5-10H,4H2,1-3H3