methyl 2-[2-[(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-[(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-[(1-methyl-4-morpholinosulfonyl-pyrrole-2-carbonyl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[[[1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolyl]-oxomethyl]amino]-2-oxoethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carbonyl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[(1-methyl-4-morpholinosulfonyl-pyrrole-2-carbonyl)amino]ethyl]thio]acetic acid methyl ester Formula: C15H21N3O7S2 MolecularWeight: 419.47314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC(=O)CSCC(=O)OC)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CN1C=C(C=C1C(=O)NC(=O)CSCC(=O)OC)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C15H21N3O7S2/c1-17-8-11(27(22,23)18-3-5-25-6-4-18)7-12(17)15(21)16-13(19)9-26-10-14(20)24-2/h7-8H,3-6,9-10H2,1-2H3,(H,16,19,21)