(2S)-2-(4-ethylphenyl)-5-oxidanylidene-1-[[(2R)-oxolan-2-yl]methyl]-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(4-ethylphenyl)-5-oxidanylidene-1-[[(2R)-oxolan-2-yl]methyl]-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-ethylphenyl)-5-oxo-1-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-ethylphenyl)-5-oxo-1-[[(2R)-2-oxolanyl]methyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-ethylphenyl)-5-oxo-1-[[(2R)-oxolan-2-yl]methyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-5-(4-ethylphenyl)-2-keto-1-[[(2R)-tetrahydrofuran-2-yl]methyl]-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C22H22NO4S- MolecularWeight: 396.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(C(=O)N2CC3CCCO3)[O-])C(=O)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2C[C@H]3CCCO3)[O-])C(=O)C4=CC=CS4

InChI

InChI=1S/C22H23NO4S/c1-2-14-7-9-15(10-8-14)19-18(20(24)17-6-4-12-28-17)21(25)22(26)23(19)13-16-5-3-11-27-16/h4,6-10,12,16,19,25H,2-3,5,11,13H2,1H3/p-1/t16-,19+/m1/s1