N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-4-methyl-N-(pyridin-3-ylmethyl)-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-4-methyl-N-(pyridin-3-ylmethyl)-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-4-methyl-N-(3-pyridylmethyl)thiadiazole-5-carboxamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-4-methyl-N-(3-pyridinylmethyl)-5-thiadiazolecarboxamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-4-methyl-N-(pyridin-3-ylmethyl)thiadiazole-5-carboxamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-4-methyl-N-(3-pyridylmethyl)thiadiazole-5-carboxamide Formula: C22H32N5OS+ MolecularWeight: 414.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)N(CC2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=C(SN=N1)C(=O)N(C[C@H]2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C22H31N5OS/c1-17-21(29-25-24-17)22(28)27(14-18-7-5-11-23-13-18)16-19-8-6-12-26(15-19)20-9-3-2-4-10-20/h5,7,11,13,19-20H,2-4,6,8-10,12,14-16H2,1H3/p+1/t19-/m0/s1