4-(4-fluorophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-N-(phenylmethyl)-1,3-thiazol-2-imine

Systemtic Name: 4-(4-fluorophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-N-(phenylmethyl)-1,3-thiazol-2-imine Openeye Name: N-benzyl-4-(4-fluorophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiazol-2-imine CAS Name: 4-(4-fluorophenyl)-3-[3-(4-morpholin-4-iumyl)propyl]-N-(phenylmethyl)-2-thiazolimine IUPAC Name: N-benzyl-4-(4-fluorophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-1,3-thiazol-2-imine Traditional Name: benzyl-[4-(4-fluorophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)-4-thiazolin-2-ylidene]amine Formula: C23H27FN3OS+ MolecularWeight: 412.543383

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=CSC2=NCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=CSC2=NCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3OS/c24-21-9-7-20(8-10-21)22-18-29-23(25-17-19-5-2-1-3-6-19)27(22)12-4-11-26-13-15-28-16-14-26/h1-3,5-10,18H,4,11-17H2/p+1