ethyl 2,4-dimethyl-5-[(2S)-2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-[4-(5-methyl-2-thienyl)-4-oxo-butanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-2-[4-(5-methyl-2-thiophenyl)-1,4-dioxobutoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-[4-(5-methylthiophen-2-yl)-4-oxobutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-[4-keto-4-(5-methyl-2-thienyl)butanoyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)CCC(=O)C2=CC=C(S2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC(=O)CCC(=O)C2=CC=C(S2)C)C

InChI

InChI=1S/C21H25NO6S/c1-6-27-21(26)18-12(3)19(22-13(18)4)20(25)14(5)28-17(24)10-8-15(23)16-9-7-11(2)29-16/h7,9,14,22H,6,8,10H2,1-5H3/t14-/m0/s1