(4-propan-2-yl-1,3-thiazol-2-yl)-[(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)piperidin-1-yl]methanone

Systemtic Name: (4-propan-2-yl-1,3-thiazol-2-yl)-[(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)piperidin-1-yl]methanone Openeye Name: (4-isopropylthiazol-2-yl)-[(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)-1-piperidyl]methanone CAS Name: (4-propan-2-yl-2-thiazolyl)-[(2S)-2-(1-pyrrolidin-1-iumylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-propan-2-yl-1,3-thiazol-2-yl)-[(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)piperidin-1-yl]methanone Traditional Name: (4-isopropylthiazol-2-yl)-[(2S)-2-(pyrrolidin-1-ium-1-ylmethyl)piperidino]methanone Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)C(=O)N2CCCCC2C[NH+]3CCCC3

Isomeric SMILES

CC(C)C1=CSC(=N1)C(=O)N2CCCC[C@H]2C[NH+]3CCCC3

InChI

InChI=1S/C17H27N3OS/c1-13(2)15-12-22-16(18-15)17(21)20-10-4-3-7-14(20)11-19-8-5-6-9-19/h12-14H,3-11H2,1-2H3/p+1/t14-/m0/s1