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

Systemtic Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-dimethylammonium IUPAC Name: [2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-dimethylazanium Traditional Name: [2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-dimethyl-ammonium Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3OS/c1-16(2)8-12(17)15-13-10(7-14)9-5-3-4-6-11(9)18-13/h3-6,8H2,1-2H3,(H,15,17)/p+1