ethyl 2-[[1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[1-(5-chloranylthiophen-2-yl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[1-[(5-chloro-2-thienyl)sulfonyl]pyrrolidine-2-carbonyl]amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[[1-[(5-chloro-2-thiophenyl)sulfonyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(5-chlorothiophen-2-yl)sulfonylpyrrolidine-2-carbonyl]amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[1-[(5-chloro-2-thienyl)sulfonyl]prolyl]amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H20ClN3O5S3 MolecularWeight: 526.0486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O5S3/c1-2-30-20(27)18-17(13-7-4-3-5-8-13)23-21(32-18)24-19(26)14-9-6-12-25(14)33(28,29)16-11-10-15(22)31-16/h3-5,7-8,10-11,14H,2,6,9,12H2,1H3,(H,23,24,26)