3-[[(4-hydroxyphenyl)-methyl-carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-hydroxyphenyl)-methyl-carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-hydroxyphenyl)-methyl-carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-hydroxy-N-methylanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4-hydroxyphenyl)-methylcarbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(4-hydroxyphenyl)-methyl-thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C13H22N3OS+ MolecularWeight: 268.39828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3OS/c1-15(2)10-4-9-14-13(18)16(3)11-5-7-12(17)8-6-11/h5-8,17H,4,9-10H2,1-3H3,(H,14,18)/p+1