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

Systemtic Name: methyl 2-[1-(4-chlorophenyl)sulfonylpyrrolidin-2-yl]carbonylimino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[1-(4-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-(4-chlorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[1-(4-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[1-(4-chlorophenyl)sulfonylprolyl]imino-3-(2-ethoxyethyl)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C24H26ClN3O6S2 MolecularWeight: 552.06274

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H26ClN3O6S2/c1-3-34-14-13-27-19-11-6-16(23(30)33-2)15-21(19)35-24(27)26-22(29)20-5-4-12-28(20)36(31,32)18-9-7-17(25)8-10-18/h6-11,15,20H,3-5,12-14H2,1-2H3