O4-ethyl O2-propan-2-yl 3-methyl-5-(pentanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-(pentanoylamino)thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-(pentanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-(1-oxopentylamino)thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 3-methyl-5-(pentanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(valerylamino)thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=C(S1)C(=O)OC(C)C)C)C(=O)OCC

Isomeric SMILES

CCCCC(=O)NC1=C(C(=C(S1)C(=O)OC(C)C)C)C(=O)OCC

InChI

InChI=1S/C17H25NO5S/c1-6-8-9-12(19)18-15-13(16(20)22-7-2)11(5)14(24-15)17(21)23-10(3)4/h10H,6-9H2,1-5H3,(H,18,19)