5-[5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylazanium

Systemtic Name: 5-[5-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylazanium Openeye Name: 5-[5-[2-(2-ethylanilino)-2-oxo-ethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylammonium CAS Name: 5-[5-[2-(2-ethylanilino)-2-oxoethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylammonium IUPAC Name: 5-[5-[2-(2-ethylanilino)-2-oxoethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylazanium Traditional Name: 5-[5-[2-(2-ethylanilino)-2-keto-ethyl]sulfonyl-1,3,4-oxadiazol-2-yl]pentylammonium Formula: C17H25N4O4S+ MolecularWeight: 381.4698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CS(=O)(=O)C2=NN=C(O2)CCCCC[NH3+]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CS(=O)(=O)C2=NN=C(O2)CCCCC[NH3+]

InChI

InChI=1S/C17H24N4O4S/c1-2-13-8-5-6-9-14(13)19-15(22)12-26(23,24)17-21-20-16(25-17)10-4-3-7-11-18/h5-6,8-9H,2-4,7,10-12,18H2,1H3,(H,19,22)/p+1