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

Systemtic Name: (3S)-N-phenyl-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-N-phenyl-1-[(2-pyrrolidin-1-ylthiazol-5-yl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-N-phenyl-1-[[2-(1-pyrrolidinyl)-5-thiazolyl]methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-N-phenyl-1-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Traditional Name: phenyl-[(3S)-1-[(2-pyrrolidinothiazol-5-yl)methyl]piperidin-1-ium-3-yl]amine Formula: C19H27N4S+ MolecularWeight: 343.50948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4S/c1-2-7-16(8-3-1)21-17-9-6-10-22(14-17)15-18-13-20-19(24-18)23-11-4-5-12-23/h1-3,7-8,13,17,21H,4-6,9-12,14-15H2/p+1/t17-/m0/s1