3-[(4-methylphenyl)-(2-thiophen-2-ylethanoyl)amino]propylazanium

Systemtic Name: 3-[(4-methylphenyl)-(2-thiophen-2-ylethanoyl)amino]propylazanium Openeye Name: 3-(4-methyl-N-[2-(2-thienyl)acetyl]anilino)propylammonium CAS Name: 3-(4-methyl-N-(1-oxo-2-thiophen-2-ylethyl)anilino)propylammonium IUPAC Name: 3-(4-methyl-N-(2-thiophen-2-ylacetyl)anilino)propylazanium Traditional Name: 3-(4-methyl-N-[2-(2-thienyl)acetyl]anilino)propylammonium Formula: C16H21N2OS+ MolecularWeight: 289.41574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2OS/c1-13-5-7-14(8-6-13)18(10-3-9-17)16(19)12-15-4-2-11-20-15/h2,4-8,11H,3,9-10,12,17H2,1H3/p+1