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

Systemtic Name: methyl 4-cyano-5-(hexanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-(hexanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-(1-oxohexylamino)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-(hexanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(caproylamino)-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O3S/c1-4-5-6-7-11(17)16-13-10(8-15)9(2)12(20-13)14(18)19-3/h4-7H2,1-3H3,(H,16,17)