4-[(1-methylpyrazol-4-yl)methyl-(2-pyrrolidin-1-ylsulfonylethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(1-methylpyrazol-4-yl)methyl-(2-pyrrolidin-1-ylsulfonylethyl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(1-methylpyrazol-4-yl)methyl-(2-pyrrolidin-1-ylsulfonylethyl)amino]-4-oxo-butanoate CAS Name: 4-[(1-methyl-4-pyrazolyl)methyl-[2-(1-pyrrolidinylsulfonyl)ethyl]amino]-4-oxobutanoate IUPAC Name: 4-[(1-methylpyrazol-4-yl)methyl-(2-pyrrolidin-1-ylsulfonylethyl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(1-methylpyrazol-4-yl)methyl-(2-pyrrolidinosulfonylethyl)amino]butyrate Formula: C15H23N4O5S- MolecularWeight: 371.43192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(CCS(=O)(=O)N2CCCC2)C(=O)CCC(=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CN(CCS(=O)(=O)N2CCCC2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H24N4O5S/c1-17-11-13(10-16-17)12-18(14(20)4-5-15(21)22)8-9-25(23,24)19-6-2-3-7-19/h10-11H,2-9,12H2,1H3,(H,21,22)/p-1