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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-methyl-amino]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(4-dimethylaminophenyl)methyl-methylamino]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[4-(dimethylamino)benzyl]-methyl-amino]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN(C)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN(C)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C19H24N4O2S/c1-5-25-19(24)17-16(15(10-20)18(21)26-17)12-23(4)11-13-6-8-14(9-7-13)22(2)3/h6-9H,5,11-12,21H2,1-4H3