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

Systemtic Name: N-[(2R)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[(2R)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiadiazole-5-carboxamide CAS Name: N-[(2R)-2-(4-chlorophenyl)-2-(1-piperidin-1-iumyl)ethyl]-4-methyl-5-thiadiazolecarboxamide IUPAC Name: N-[(2R)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-ylethyl]-4-methylthiadiazole-5-carboxamide Traditional Name: N-[(2R)-2-(4-chlorophenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-methyl-thiadiazole-5-carboxamide Formula: C17H22ClN4OS+ MolecularWeight: 365.90078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN4OS/c1-12-16(24-21-20-12)17(23)19-11-15(22-9-3-2-4-10-22)13-5-7-14(18)8-6-13/h5-8,15H,2-4,9-11H2,1H3,(H,19,23)/p+1/t15-/m0/s1