(3-fluoranyl-4-methyl-phenyl)-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: (3-fluoranyl-4-methyl-phenyl)-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: (3-fluoro-4-methyl-phenyl)-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: (3-fluoro-4-methylphenyl)-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: (3-fluoro-4-methylphenyl)-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: (3-fluoro-4-methyl-phenyl)-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]ammonium Formula: C18H21FN3O2S+ MolecularWeight: 362.441643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[NH2+]CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)F

Isomeric SMILES

CC1=C(C=C(C=C1)[NH2+]CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)F

InChI

InChI=1S/C18H20FN3O2S/c1-13-4-5-14(11-15(13)19)20-12-17(23)21-6-8-22(9-7-21)18(24)16-3-2-10-25-16/h2-5,10-11,20H,6-9,12H2,1H3/p+1