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

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(2-methylbutan-2-yl)azanium Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-(1,1-dimethylpropyl)ammonium CAS Name: [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]ammonium Formula: C12H18N3OS+ MolecularWeight: 252.35582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]CC(=O)NC1=C(C=CS1)C#N

Isomeric SMILES

CCC(C)(C)[NH2+]CC(=O)NC1=C(C=CS1)C#N

InChI

InChI=1S/C12H17N3OS/c1-4-12(2,3)14-8-10(16)15-11-9(7-13)5-6-17-11/h5-6,14H,4,8H2,1-3H3,(H,15,16)/p+1