ethyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[4-(4-fluorophenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[4-(4-fluorophenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-ethoxy-2-oxo-ethyl)-2-[4-(4-fluorophenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-[4-[(4-fluorophenyl)thio]-1-oxobutyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-ethoxy-2-oxoethyl)-2-[4-(4-fluorophenyl)sulfanylbutanoylimino]-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-[4-[(4-fluorophenyl)thio]butanoylimino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C24H25FN2O5S2 MolecularWeight: 504.594103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CCCSC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C24H25FN2O5S2/c1-3-31-22(29)15-27-19-12-7-16(23(30)32-4-2)14-20(19)34-24(27)26-21(28)6-5-13-33-18-10-8-17(25)9-11-18/h7-12,14H,3-6,13,15H2,1-2H3