N-[2-(4-butanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[2-(4-butanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide Openeye Name: N-[2-(4-butanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-N-[2-[4-(1-oxobutyl)-1-piperazinyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4-butanoylpiperazin-1-yl)ethyl]-N-[(4-fluorophenyl)methyl]thiophene-2-carboxamide Traditional Name: N-[2-(4-butyrylpiperazino)ethyl]-N-(4-fluorobenzyl)thiophene-2-carboxamide Formula: C22H28FN3O2S MolecularWeight: 417.540023

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)C3=CC=CS3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)CCN(CC2=CC=C(C=C2)F)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H28FN3O2S/c1-2-4-21(27)25-13-10-24(11-14-25)12-15-26(22(28)20-5-3-16-29-20)17-18-6-8-19(23)9-7-18/h3,5-9,16H,2,4,10-15,17H2,1H3