(3S)-N-(4-fluorophenyl)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-(4-fluorophenyl)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-N-(4-fluorophenyl)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-N-(4-fluorophenyl)-1-[(4-propan-2-yl-2-thiazolyl)methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-N-(4-fluorophenyl)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-amine Traditional Name: (4-fluorophenyl)-[(3S)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-yl]amine Formula: C18H25FN3S+ MolecularWeight: 334.474603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)C[NH+]2CCCC(C2)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=CSC(=N1)C[NH+]2CCC[C@@H](C2)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN3S/c1-13(2)17-12-23-18(21-17)11-22-9-3-4-16(10-22)20-15-7-5-14(19)6-8-15/h5-8,12-13,16,20H,3-4,9-11H2,1-2H3/p+1/t16-/m0/s1