ethyl 2-[2-[[1-(2-butan-2-ylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[1-(2-butan-2-ylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[5-oxo-1-(2-sec-butylphenyl)pyrrolidine-3-carbonyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[1-(2-butan-2-ylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[1-(2-butan-2-ylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[5-keto-1-(2-sec-butylphenyl)pyrrolidine-3-carbonyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=NC(=CS3)CC(=O)OCC

Isomeric SMILES

CCC(C)C1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=NC(=CS3)CC(=O)OCC

InChI

InChI=1S/C22H27N3O4S/c1-4-14(3)17-8-6-7-9-18(17)25-12-15(10-19(25)26)21(28)24-22-23-16(13-30-22)11-20(27)29-5-2/h6-9,13-15H,4-5,10-12H2,1-3H3,(H,23,24,28)