ethyl 2-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[(3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[(3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(3S)-5-keto-1-p-phenetyl-pyrrolidine-3-carbonyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC(=C(S3)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=NC(=C(S3)C(=O)OCC)C

InChI

InChI=1S/C20H23N3O5S/c1-4-27-15-8-6-14(7-9-15)23-11-13(10-16(23)24)18(25)22-20-21-12(3)17(29-20)19(26)28-5-2/h6-9,13H,4-5,10-11H2,1-3H3,(H,21,22,25)/t13-/m0/s1