dimethyl-[[5-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium

Systemtic Name: dimethyl-[[5-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium Openeye Name: [5-[[(4-isopropylphenyl)carbamothioylamino]carbamoyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: dimethyl-[[5-[oxo-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazo]methyl]-2-furanyl]methyl]ammonium IUPAC Name: dimethyl-[[5-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl]azanium Traditional Name: dimethyl-[[5-[(p-cumenylthiocarbamoylamino)carbamoyl]-2-furyl]methyl]ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O2S/c1-12(2)13-5-7-14(8-6-13)19-18(25)21-20-17(23)16-10-9-15(24-16)11-22(3)4/h5-10,12H,11H2,1-4H3,(H,20,23)(H2,19,21,25)/p+1