dimethyl-[[5-[[(3-methylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium

Systemtic Name: dimethyl-[[5-[[(3-methylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium Openeye Name: dimethyl-[[5-[(m-tolylcarbamothioylamino)carbamoyl]-2-furyl]methyl]ammonium CAS Name: dimethyl-[[5-[[[(3-methylanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]-2-furanyl]methyl]ammonium IUPAC Name: dimethyl-[[5-[[(3-methylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium Traditional Name: dimethyl-[[5-[(m-tolylthiocarbamoylamino)carbamoyl]-2-furyl]methyl]ammonium Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC(=O)C2=CC=C(O2)C[NH+](C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC(=O)C2=CC=C(O2)C[NH+](C)C

InChI

InChI=1S/C16H20N4O2S/c1-11-5-4-6-12(9-11)17-16(23)19-18-15(21)14-8-7-13(22-14)10-20(2)3/h4-9H,10H2,1-3H3,(H,18,21)(H2,17,19,23)/p+1