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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(4-dimethylaminophenyl)methyl-ethyl-amino]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-ethyl-amino]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-ethylamino]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-ethylamino]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[4-(dimethylamino)benzyl]-ethyl-amino]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N(C)C)CC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=C(C=C1)N(C)C)CC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C20H26N4O2S/c1-5-24(12-14-7-9-15(10-8-14)23(3)4)13-17-16(11-21)19(22)27-18(17)20(25)26-6-2/h7-10H,5-6,12-13,22H2,1-4H3