[2-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-triethyl-azanium iodide

Systemtic Name: [2-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-triethyl-azanium iodide Openeye Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-triethyl-ammonium iodide CAS Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-triethylammonium iodide IUPAC Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-triethylazanium iodide Traditional Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-triethyl-ammonium iodide Formula: C17H28IN3O2S MolecularWeight: 465.39259

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N.[I-]

Isomeric SMILES

CC[N+](CC)(CC)CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N.[I-]

InChI

InChI=1S/C17H27N3O2S.HI/c1-4-20(5-2,6-3)11-14(21)19-17-15(16(18)22)12-9-7-8-10-13(12)23-17;/h4-11H2,1-3H3,(H2-,18,19,21,22);1H