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

Systemtic Name: ethyl 5-azanyl-3-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C15H16BrN3O2S2 MolecularWeight: 414.34044

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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(S2)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN(C)CC2=CC=C(S2)Br

InChI

InChI=1S/C15H16BrN3O2S2/c1-3-21-15(20)13-11(10(6-17)14(18)23-13)8-19(2)7-9-4-5-12(16)22-9/h4-5H,3,7-8,18H2,1-2H3