ethyl 5-azanyl-4-cyano-3-[(4-dimethylaminophenyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-dimethylaminophenyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[4-(dimethylamino)benzoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[4-(dimethylamino)benzoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[4-(dimethylamino)benzoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4S/c1-4-24-18(23)15-14(13(9-19)16(20)26-15)10-25-17(22)11-5-7-12(8-6-11)21(2)3/h5-8H,4,10,20H2,1-3H3