2-morpholin-4-ium-4-yl-N-[5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-morpholin-4-ium-4-yl-N-[5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-(2-anilino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[5-[(2-anilino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[5-(2-anilino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[5-[(2-anilino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide Formula: C16H20N5O3S2+ MolecularWeight: 394.4917

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O3S2/c22-13(10-21-6-8-24-9-7-21)18-15-19-20-16(26-15)25-11-14(23)17-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,17,23)(H,18,19,22)/p+1