(3S)-N-(3-fluorophenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-(3-fluorophenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-N-(3-fluorophenyl)-1-[(2-pyrrolidin-1-ylthiazol-5-yl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-N-(3-fluorophenyl)-1-[[2-(1-pyrrolidinyl)-5-thiazolyl]methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-N-(3-fluorophenyl)-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Traditional Name: (3-fluorophenyl)-[(3S)-1-[(2-pyrrolidinothiazol-5-yl)methyl]piperidin-1-ium-3-yl]amine Formula: C19H26FN4S+ MolecularWeight: 361.499943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(S2)C[NH+]3CCCC(C3)NC4=CC(=CC=C4)F

Isomeric SMILES

C1CCN(C1)C2=NC=C(S2)C[NH+]3CCC[C@@H](C3)NC4=CC(=CC=C4)F

InChI

InChI=1S/C19H25FN4S/c20-15-5-3-6-16(11-15)22-17-7-4-8-23(13-17)14-18-12-21-19(25-18)24-9-1-2-10-24/h3,5-6,11-12,17,22H,1-2,4,7-10,13-14H2/p+1/t17-/m0/s1