3-[(2-methoxyphenyl)carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2-methoxyphenyl)carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(2-methoxyphenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2-methoxyphenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(2-methoxyphenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C13H22N3OS+ MolecularWeight: 268.39828

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=CC=CC=C1OC

InChI

InChI=1S/C13H21N3OS/c1-16(2)10-6-9-14-13(18)15-11-7-4-5-8-12(11)17-3/h4-5,7-8H,6,9-10H2,1-3H3,(H2,14,15,18)/p+1