ethyl 5-(2-chloranylethanoylamino)-4-cyano-3-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-(2-chloranylethanoylamino)-4-cyano-3-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(2-chloroacetyl)amino]-4-cyano-3-phenyl-thiophene-2-carboxylate CAS Name: 5-[(2-chloro-1-oxoethyl)amino]-4-cyano-3-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-chloroacetyl)amino]-4-cyano-3-phenylthiophene-2-carboxylate Traditional Name: 5-[(2-chloroacetyl)amino]-4-cyano-3-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCl)C#N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCl)C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H13ClN2O3S/c1-2-22-16(21)14-13(10-6-4-3-5-7-10)11(9-18)15(23-14)19-12(20)8-17/h3-7H,2,8H2,1H3,(H,19,20)