3-[(3,5-dimethylphenyl)-(2-thiophen-2-ylethanoyl)amino]propylazanium

Systemtic Name: 3-[(3,5-dimethylphenyl)-(2-thiophen-2-ylethanoyl)amino]propylazanium Openeye Name: 3-(3,5-dimethyl-N-[2-(2-thienyl)acetyl]anilino)propylammonium CAS Name: 3-(3,5-dimethyl-N-(1-oxo-2-thiophen-2-ylethyl)anilino)propylammonium IUPAC Name: 3-(3,5-dimethyl-N-(2-thiophen-2-ylacetyl)anilino)propylazanium Traditional Name: 3-(3,5-dimethyl-N-[2-(2-thienyl)acetyl]anilino)propylammonium Formula: C17H23N2OS+ MolecularWeight: 303.44232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC[NH3+])C(=O)CC2=CC=CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC[NH3+])C(=O)CC2=CC=CS2)C

InChI

InChI=1S/C17H22N2OS/c1-13-9-14(2)11-15(10-13)19(7-4-6-18)17(20)12-16-5-3-8-21-16/h3,5,8-11H,4,6-7,12,18H2,1-2H3/p+1