[2-[[2-ethyl-5-(2-thiophen-2-ylethanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[2-ethyl-5-(2-thiophen-2-ylethanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[2-ethyl-5-[[2-(2-thienyl)acetyl]amino]anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-ethyl-5-[(1-oxo-2-thiophen-2-ylethyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[2-ethyl-5-[(2-thiophen-2-ylacetyl)amino]anilino]-2-oxoethyl]azanium Traditional Name: [2-[2-ethyl-5-[[2-(2-thienyl)acetyl]amino]anilino]-2-keto-ethyl]ammonium Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)CC2=CC=CS2)NC(=O)C[NH3+]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)CC2=CC=CS2)NC(=O)C[NH3+]

InChI

InChI=1S/C16H19N3O2S/c1-2-11-5-6-12(8-14(11)19-16(21)10-17)18-15(20)9-13-4-3-7-22-13/h3-8H,2,9-10,17H2,1H3,(H,18,20)(H,19,21)/p+1