[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: [2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: [2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl] 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid [2-[4-(2-fluorophenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl] 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid [2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl] ester Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)COC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)COC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H24FN3O4S/c22-17-4-1-2-5-18(17)24-9-11-25(12-10-24)19(26)14-29-20(27)6-3-8-23-21(28)16-7-13-30-15-16/h1-2,4-5,7,13,15H,3,6,8-12,14H2,(H,23,28)