methyl 4-cyano-5-(heptanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-(heptanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-(heptanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-(1-oxoheptylamino)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-(heptanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(enanthylamino)-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C(C(=C(S1)C(=O)OC)C)C#N

Isomeric SMILES

CCCCCCC(=O)NC1=C(C(=C(S1)C(=O)OC)C)C#N

InChI

InChI=1S/C15H20N2O3S/c1-4-5-6-7-8-12(18)17-14-11(9-16)10(2)13(21-14)15(19)20-3/h4-8H2,1-3H3,(H,17,18)