2-(2-chloranyl-6-fluoranyl-phenyl)-4-(piperazin-4-ium-1-ylmethyl)-1,3-thiazole

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-4-(piperazin-4-ium-1-ylmethyl)-1,3-thiazole Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-4-(piperazin-4-ium-1-ylmethyl)thiazole CAS Name: 2-(2-chloro-6-fluorophenyl)-4-(1-piperazin-4-iumylmethyl)thiazole IUPAC Name: 2-(2-chloro-6-fluorophenyl)-4-(piperazin-4-ium-1-ylmethyl)-1,3-thiazole Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-4-(piperazin-4-ium-1-ylmethyl)thiazole Formula: C14H16ClFN3S+ MolecularWeight: 312.813343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CSC(=N2)C3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CSC(=N2)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C14H15ClFN3S/c15-11-2-1-3-12(16)13(11)14-18-10(9-20-14)8-19-6-4-17-5-7-19/h1-3,9,17H,4-8H2/p+1