methyl 5-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(1,1-dioxothiolan-3-yl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[(1,1-dioxo-3-thiolanyl)amino]-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(1,1-dioxothiolan-3-yl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(1,1-diketothiolan-3-yl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2CCS(=O)(=O)C2)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2CCS(=O)(=O)C2)C)C(=O)OC

InChI

InChI=1S/C14H20N2O5S/c1-4-10-11(14(18)21-3)8(2)12(16-10)13(17)15-9-5-6-22(19,20)7-9/h9,16H,4-7H2,1-3H3,(H,15,17)