[2-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: [2-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl] 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: [2-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-2-oxo-ethyl] 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid [2-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl] 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid [2-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-2-keto-ethyl] ester Formula: C22H21FN2O4S2 MolecularWeight: 460.541543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(C2=CC=C(C=C2)F)NC(=O)COC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1=CSC(=C1)C(C2=CC=C(C=C2)F)NC(=O)COC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C22H21FN2O4S2/c23-17-7-5-15(6-8-17)21(18-3-2-11-31-18)25-19(26)13-29-20(27)4-1-10-24-22(28)16-9-12-30-14-16/h2-3,5-9,11-12,14,21H,1,4,10,13H2,(H,24,28)(H,25,26)