2-[3-[2-[(2-fluorophenyl)methylamino]-4-methyl-1,3-thiazol-5-yl]pyrazol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[2-[(2-fluorophenyl)methylamino]-4-methyl-1,3-thiazol-5-yl]pyrazol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-[2-[(2-fluorophenyl)methylamino]-4-methyl-thiazol-5-yl]pyrazol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[3-[2-[(2-fluorophenyl)methylamino]-4-methyl-5-thiazolyl]-1-pyrazolyl]ethyl-dimethylammonium IUPAC Name: 2-[3-[2-[(2-fluorophenyl)methylamino]-4-methyl-1,3-thiazol-5-yl]pyrazol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-[2-[(2-fluorobenzyl)amino]-4-methyl-thiazol-5-yl]pyrazol-1-yl]ethyl-dimethyl-ammonium Formula: C18H23FN5S+ MolecularWeight: 360.472123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCC2=CC=CC=C2F)C3=NN(C=C3)CC[NH+](C)C

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CC=CC=C2F)C3=NN(C=C3)CC[NH+](C)C

InChI

InChI=1S/C18H22FN5S/c1-13-17(16-8-9-24(22-16)11-10-23(2)3)25-18(21-13)20-12-14-6-4-5-7-15(14)19/h4-9H,10-12H2,1-3H3,(H,20,21)/p+1