O2-methyl O4-propyl 3-methyl-5-[3-(3-methylpyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-methyl O4-propyl 3-methyl-5-[3-(3-methylpyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-methyl O4-propyl 3-methyl-5-[3-(3-methylpyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[3-(3-methyl-1-pyrazolyl)-1-oxopropyl]amino]thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propyl ester IUPAC Name: 2-O-methyl 4-O-propyl 3-methyl-5-[3-(3-methylpyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[3-(3-methylpyrazol-1-yl)propanoylamino]thiophene-2,4-dicarboxylic acid O2-methyl ester O4-propyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CCN2C=CC(=N2)C

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CCN2C=CC(=N2)C

InChI

InChI=1S/C18H23N3O5S/c1-5-10-26-17(23)14-12(3)15(18(24)25-4)27-16(14)19-13(22)7-9-21-8-6-11(2)20-21/h6,8H,5,7,9-10H2,1-4H3,(H,19,22)