ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]imino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]imino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]imino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[1-(4-fluorophenyl)sulfonylisonipecotoyl]imino-3-(2-methoxyethyl)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C25H28FN3O6S2 MolecularWeight: 549.634723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F)S2)CCOC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F)S2)CCOC

InChI

InChI=1S/C25H28FN3O6S2/c1-3-35-24(31)18-4-9-21-22(16-18)36-25(29(21)14-15-34-2)27-23(30)17-10-12-28(13-11-17)37(32,33)20-7-5-19(26)6-8-20/h4-9,16-17H,3,10-15H2,1-2H3