[5-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethyl-azanium

Systemtic Name: [5-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethyl-azanium Openeye Name: [5-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: [5-[[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]hydrazo]-oxomethyl]-2-furanyl]methyl-dimethylammonium IUPAC Name: [5-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethylazanium Traditional Name: dimethyl-[[5-[(p-anisylthiocarbamoylamino)carbamoyl]-2-furyl]methyl]ammonium Formula: C17H23N4O3S+ MolecularWeight: 363.45452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3S/c1-21(2)11-14-8-9-15(24-14)16(22)19-20-17(25)18-10-12-4-6-13(23-3)7-5-12/h4-9H,10-11H2,1-3H3,(H,19,22)(H2,18,20,25)/p+1