ethyl 4-[10-(5-methylthiophen-2-yl)dec-9-ynylamino]benzoate

Systemtic Name: ethyl 4-[10-(5-methylthiophen-2-yl)dec-9-ynylamino]benzoate Openeye Name: ethyl 4-[10-(5-methyl-2-thienyl)dec-9-ynylamino]benzoate CAS Name: 4-[10-(5-methyl-2-thiophenyl)dec-9-ynylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[10-(5-methylthiophen-2-yl)dec-9-ynylamino]benzoate Traditional Name: 4-[10-(5-methyl-2-thienyl)dec-9-ynylamino]benzoic acid ethyl ester Formula: C24H31NO2S MolecularWeight: 397.57344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCCCCCCCC#CC2=CC=C(S2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCCCCCCCC#CC2=CC=C(S2)C

InChI

InChI=1S/C24H31NO2S/c1-3-27-24(26)21-14-16-22(17-15-21)25-19-11-9-7-5-4-6-8-10-12-23-18-13-20(2)28-23/h13-18,25H,3-9,11,19H2,1-2H3