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

Systemtic Name: methyl 4-cyano-3-methyl-5-(undecanoylamino)thiophene-2-carboxylate Openeye Name: methyl 4-cyano-3-methyl-5-(undecanoylamino)thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-(1-oxoundecylamino)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-methyl-5-(undecanoylamino)thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-(undecanoylamino)thiophene-2-carboxylic acid methyl ester Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O3S/c1-4-5-6-7-8-9-10-11-12-16(22)21-18-15(13-20)14(2)17(25-18)19(23)24-3/h4-12H2,1-3H3,(H,21,22)