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

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-m-anisyl-methyl-ammonium Formula: C16H18N3O2S+ MolecularWeight: 316.39802

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C16H17N3O2S/c1-19(10-12-4-3-5-14(8-12)21-2)11-15(20)18-16-13(9-17)6-7-22-16/h3-8H,10-11H2,1-2H3,(H,18,20)/p+1