4-methyl-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-methyl-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]thiadiazole-5-carboxamide CAS Name: 4-methyl-N-[(2R)-2-phenyl-2-(1-piperidin-1-iumyl)ethyl]-5-thiadiazolecarboxamide IUPAC Name: 4-methyl-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-ylethyl]thiadiazole-5-carboxamide Traditional Name: 4-methyl-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]thiadiazole-5-carboxamide Formula: C17H23N4OS+ MolecularWeight: 331.45572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCCC3

Isomeric SMILES

CC1=C(SN=N1)C(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCCC3

InChI

InChI=1S/C17H22N4OS/c1-13-16(23-20-19-13)17(22)18-12-15(14-8-4-2-5-9-14)21-10-6-3-7-11-21/h2,4-5,8-9,15H,3,6-7,10-12H2,1H3,(H,18,22)/p+1/t15-/m0/s1