[(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-[2-(2-thienyl)thiazol-4-yl]acetate CAS Name: 2-(2-thiophen-2-yl-4-thiazolyl)acetic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(2-thienyl)thiazol-4-yl]acetic acid [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)OC(=O)CC2=CSC(=N2)C3=CC=CS3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)CC2=CSC(=N2)C3=CC=CS3

InChI

InChI=1S/C20H20N2O4S2/c1-10-17(12(3)23)11(2)21-18(10)19(25)13(4)26-16(24)8-14-9-28-20(22-14)15-6-5-7-27-15/h5-7,9,13,21H,8H2,1-4H3/t13-/m0/s1