[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-[2-(dimethylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-[2-(dimethylamino)-2-oxoethyl]-methylammonium IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-[2-(dimethylamino)-2-oxoethyl]-methylazanium Traditional Name: [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-[2-(dimethylamino)-2-keto-ethyl]-methyl-ammonium Formula: C12H17N4O2S+ MolecularWeight: 281.35398

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=C(C=CS1)C#N)CC(=O)N(C)C

Isomeric SMILES

C[NH+](CC(=O)NC1=C(C=CS1)C#N)CC(=O)N(C)C

InChI

InChI=1S/C12H16N4O2S/c1-15(2)11(18)8-16(3)7-10(17)14-12-9(6-13)4-5-19-12/h4-5H,7-8H2,1-3H3,(H,14,17)/p+1