aminocarbonyl-[2-(4-chlorophenyl)sulfanylethyl]-(2-dimethylaminoethyl)-propan-2-yl-azanium

Systemtic Name: aminocarbonyl-[2-(4-chlorophenyl)sulfanylethyl]-(2-dimethylaminoethyl)-propan-2-yl-azanium Openeye Name: carbamoyl-[2-(4-chlorophenyl)sulfanylethyl]-(2-dimethylaminoethyl)-isopropyl-ammonium CAS Name: carbamoyl-[2-[(4-chlorophenyl)thio]ethyl]-(2-dimethylaminoethyl)-propan-2-ylammonium IUPAC Name: carbamoyl-[2-(4-chlorophenyl)sulfanylethyl]-(2-dimethylaminoethyl)-propan-2-ylazanium Traditional Name: carbamoyl-[2-[(4-chlorophenyl)thio]ethyl]-(2-dimethylaminoethyl)-isopropyl-ammonium Formula: C16H27ClN3OS+ MolecularWeight: 344.92308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](CCN(C)C)(CCSC1=CC=C(C=C1)Cl)C(=O)N

Isomeric SMILES

CC(C)[N+](CCN(C)C)(CCSC1=CC=C(C=C1)Cl)C(=O)N

InChI

InChI=1S/C16H26ClN3OS/c1-13(2)20(16(18)21,10-9-19(3)4)11-12-22-15-7-5-14(17)6-8-15/h5-8,13H,9-12H2,1-4H3,(H-,18,21)/p+1