dimethyl-[[5-[[(phenylmethyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium

Systemtic Name: dimethyl-[[5-[[(phenylmethyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium Openeye Name: [5-[(benzylcarbamothioylamino)carbamoyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: dimethyl-[[5-[oxo-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]methyl]-2-furanyl]methyl]ammonium IUPAC Name: [5-[(benzylcarbamothioylamino)carbamoyl]furan-2-yl]methyl-dimethylazanium Traditional Name: [5-[(benzylthiocarbamoylamino)carbamoyl]-2-furyl]methyl-dimethyl-ammonium Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(O1)C(=O)NNC(=S)NCC2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CC1=CC=C(O1)C(=O)NNC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H20N4O2S/c1-20(2)11-13-8-9-14(22-13)15(21)18-19-16(23)17-10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3,(H,18,21)(H2,17,19,23)/p+1