2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]ethyl-diethyl-azanium Openeye Name: 2-[(3-chloro-2-methyl-phenyl)carbamothioylamino]ethyl-diethyl-ammonium CAS Name: 2-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(3-chloro-2-methylphenyl)carbamothioylamino]ethyl-diethylazanium Traditional Name: 2-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]ethyl-diethyl-ammonium Formula: C14H23ClN3S+ MolecularWeight: 300.87052

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=S)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CC[NH+](CC)CCNC(=S)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C14H22ClN3S/c1-4-18(5-2)10-9-16-14(19)17-13-8-6-7-12(15)11(13)3/h6-8H,4-5,9-10H2,1-3H3,(H2,16,17,19)/p+1