4-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1,2,3-thiadiazole-5-carboxamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NC2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SN=N1)C(=O)N[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

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