2-[(4-carbamothioylpyridin-2-yl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(4-carbamothioylpyridin-2-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(4-carbamothioyl-2-pyridyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(4-carbamothioyl-2-pyridinyl)amino]ethyl-diethylammonium IUPAC Name: 2-[(4-carbamothioylpyridin-2-yl)amino]ethyl-diethylazanium Traditional Name: diethyl-[2-[(4-thiocarbamoyl-2-pyridyl)amino]ethyl]ammonium Formula: C12H21N4S+ MolecularWeight: 253.38694

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=NC=CC(=C1)C(=S)N

Isomeric SMILES

CC[NH+](CC)CCNC1=NC=CC(=C1)C(=S)N

InChI

InChI=1S/C12H20N4S/c1-3-16(4-2)8-7-15-11-9-10(12(13)17)5-6-14-11/h5-6,9H,3-4,7-8H2,1-2H3,(H2,13,17)(H,14,15)/p+1