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

Systemtic Name: methyl 5-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[(3S)-1,1-dioxothiolan-3-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[(3S)-1,1-dioxo-3-thiolanyl]amino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[(3S)-1,1-dioxothiolan-3-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(3S)-1,1-diketothiolan-3-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2CCS(=O)(=O)C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)N[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C13H18N2O5S/c1-7-10(13(17)20-3)8(2)14-11(7)12(16)15-9-4-5-21(18,19)6-9/h9,14H,4-6H2,1-3H3,(H,15,16)/t9-/m0/s1