O4-ethyl O2-methyl 5-[3-(cyclohexylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 5-[3-(cyclohexylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-[3-(cyclohexylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[3-(cyclohexylamino)-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-[3-(cyclohexylamino)propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-(cyclohexylamino)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CCNC2CCCCC2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)CCNC2CCCCC2

InChI

InChI=1S/C19H28N2O5S/c1-4-26-18(23)15-12(2)16(19(24)25-3)27-17(15)21-14(22)10-11-20-13-8-6-5-7-9-13/h13,20H,4-11H2,1-3H3,(H,21,22)