N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetamide Formula: C17H29N4OS2+ MolecularWeight: 369.56836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC(=O)NC2CCC[NH+](C2)C3CCCCCC3

Isomeric SMILES

CC1=NN=C(S1)SCC(=O)N[C@H]2CCC[NH+](C2)C3CCCCCC3

InChI

InChI=1S/C17H28N4OS2/c1-13-19-20-17(24-13)23-12-16(22)18-14-7-6-10-21(11-14)15-8-4-2-3-5-9-15/h14-15H,2-12H2,1H3,(H,18,22)/p+1/t14-/m0/s1