N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C16H20N4O2S/c1-2-14-18-19-16(23-14)17-15(21)13-5-3-12(4-6-13)11-20-7-9-22-10-8-20/h3-6H,2,7-11H2,1H3,(H,17,19,21)/p+1