N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C15H18N5O3S+ MolecularWeight: 348.40012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O3S/c21-13(10-19-8-2-1-3-9-19)16-15-18-17-14(24-15)11-4-6-12(7-5-11)20(22)23/h4-7H,1-3,8-10H2,(H,16,18,21)/p+1