ethyl 5-[(3-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(3-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(3-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(3-chloroanilino)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-chlorophenyl)carbamoylamino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(3-chlorophenyl)carbamoylamino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)NC2=CC(=CC=C2)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)NC2=CC(=CC=C2)Cl)C#N)C

InChI

InChI=1S/C16H14ClN3O3S/c1-3-23-15(21)13-9(2)12(8-18)14(24-13)20-16(22)19-11-6-4-5-10(17)7-11/h4-7H,3H2,1-2H3,(H2,19,20,22)