1-[(6-methylpyridin-2-yl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(6-methylpyridin-2-yl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(6-methyl-2-pyridyl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(6-methylpyridin-2-yl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(6-methyl-2-pyridyl)methyl]-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C22H26N5OS+ MolecularWeight: 408.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=NN=C(S4)C

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=NN=C(S4)C

InChI

InChI=1S/C22H25N5OS/c1-15-5-3-8-20(23-15)14-27-11-9-17(10-12-27)21(28)24-19-7-4-6-18(13-19)22-26-25-16(2)29-22/h3-8,13,17H,9-12,14H2,1-2H3,(H,24,28)/p+1