methyl 2-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[1-(4-chlorophenyl)sulfonylisonipecotoyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C25H28ClN3O6S2 MolecularWeight: 566.08932

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H28ClN3O6S2/c1-3-35-15-14-29-21-9-4-18(24(31)34-2)16-22(21)36-25(29)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