[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl]-methyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: [2-(4-fluoroanilino)-2-oxoethyl]-methyl-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl]-methyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: [2-(4-fluoroanilino)-2-keto-ethyl]-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]-methyl-ammonium Formula: C20H24FN4O3S+ MolecularWeight: 419.492963

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=CC=C(C=C1)F)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

C[NH+](CC(=O)NC1=CC=C(C=C1)F)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C20H23FN4O3S/c1-23(13-18(26)22-16-6-4-15(21)5-7-16)14-19(27)24-8-10-25(11-9-24)20(28)17-3-2-12-29-17/h2-7,12H,8-11,13-14H2,1H3,(H,22,26)/p+1