(2S)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxidanylidene-2-(4-propan-2-ylphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxidanylidene-2-(4-propan-2-ylphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-isopropylphenyl)-1-(5-methylisoxazol-3-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-1-(5-methyl-3-isoxazolyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2-(4-propan-2-ylphenyl)-2H-pyrrol-4-olate IUPAC Name: (2S)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxo-2-(4-propan-2-ylphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-2-keto-1-(5-methylisoxazol-3-yl)-5-p-cumenyl-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C22H19N2O4S- MolecularWeight: 407.46226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C(C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC(=NO1)N2[C@H](C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C22H20N2O4S/c1-12(2)14-6-8-15(9-7-14)19-18(20(25)16-5-4-10-29-16)21(26)22(27)24(19)17-11-13(3)28-23-17/h4-12,19,26H,1-3H3/p-1/t19-/m0/s1