2-[(4-carbamothioylphenyl)carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-carbamothioylphenyl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-carbamothioylbenzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(4-carbamothioylphenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-carbamothioylbenzoyl)amino]ethyl-dimethylazanium Traditional Name: dimethyl-[2-[(4-thiocarbamoylbenzoyl)amino]ethyl]ammonium Formula: C12H18N3OS+ MolecularWeight: 252.35582

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC=C(C=C1)C(=S)N

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C12H17N3OS/c1-15(2)8-7-14-12(16)10-5-3-9(4-6-10)11(13)17/h3-6H,7-8H2,1-2H3,(H2,13,17)(H,14,16)/p+1