[1-[1-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(4-phenylthiazol-2-yl)methyl]-4-piperidyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(4-phenyl-2-thiazolyl)methyl]-4-piperidinyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-[(4-phenylthiazol-2-yl)methyl]-4-piperidyl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C25H35N4OS+ MolecularWeight: 439.6366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)CC4=NC(=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)CC4=NC(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H34N4OS/c30-25(29-12-4-5-13-29)21-8-16-28(17-9-21)22-10-14-27(15-11-22)18-24-26-23(19-31-24)20-6-2-1-3-7-20/h1-3,6-7,19,21-22H,4-5,8-18H2/p+1