[1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(5-methyl-2-thiophenyl)methyl]-4-piperidin-1-iumyl]-4-triazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidino-methanone Formula: C18H26N5OS+ MolecularWeight: 360.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+]2CCC(CC2)N3C=C(N=N3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(S1)C[NH+]2CCC(CC2)N3C=C(N=N3)C(=O)N4CCCC4

InChI

InChI=1S/C18H25N5OS/c1-14-4-5-16(25-14)12-21-10-6-15(7-11-21)23-13-17(19-20-23)18(24)22-8-2-3-9-22/h4-5,13,15H,2-3,6-12H2,1H3/p+1