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

Systemtic Name: [2-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-azanyl-dimethyl-azanium Openeye Name: amino-[2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: amino-[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-dimethylammonium IUPAC Name: amino-[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-dimethylazanium Traditional Name: amino-[2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-dimethyl-ammonium Formula: C13H21N4O2S+ MolecularWeight: 297.39644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4O2S/c1-17(2,15)7-10(18)16-13-11(12(14)19)8-5-3-4-6-9(8)20-13/h3-7,15H2,1-2H3,(H2-,14,16,18,19)/p+1