methyl 4-[2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-1,3-thiazol-4-yl]benzoate

Systemtic Name: methyl 4-[2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-1,3-thiazol-4-yl]benzoate Openeye Name: methyl 4-[2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]thiazol-4-yl]benzoate CAS Name: 4-[2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-4-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]-1,3-thiazol-4-yl]benzoate Traditional Name: 4-[2-[(1-tosylprolyl)amino]thiazol-4-yl]benzoic acid methyl ester Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H23N3O5S2/c1-15-5-11-18(12-6-15)33(29,30)26-13-3-4-20(26)21(27)25-23-24-19(14-32-23)16-7-9-17(10-8-16)22(28)31-2/h5-12,14,20H,3-4,13H2,1-2H3,(H,24,25,27)