dimethyl 5-azanyl-3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyloxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxopropoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyloxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyloxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCC(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1)C)CCC(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C17H21N3O6S/c1-8-10(9(2)20-19-8)5-6-12(21)26-7-11-13(16(22)24-3)15(18)27-14(11)17(23)25-4/h5-7,18H2,1-4H3,(H,19,20)