1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-3-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-3-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-piperidin-1-iumcarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-3-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-3-carboxamide Formula: C17H20N5OS2+ MolecularWeight: 374.5036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)[N+]2(CCCC(C2)C(=O)N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=NN=C(S1)[N+]2(CCCC(C2)C(=O)N)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H19N5OS2/c1-2-14-20-21-17(25-14)22(9-5-6-11(10-22)15(18)23)16-19-12-7-3-4-8-13(12)24-16/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H-,18,23)/p+1