[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-[(2,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-[(2,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-(2,4-dimethoxybenzyl)-methyl-ammonium Formula: C17H20N3O3S+ MolecularWeight: 346.424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S/c1-20(10-13-4-5-14(22-2)8-15(13)23-3)11-16(21)19-17-12(9-18)6-7-24-17/h4-8H,10-11H2,1-3H3,(H,19,21)/p+1