butyl-ethyl-[[5-[[(2,4,6-trimethylphenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[5-[[(2,4,6-trimethylphenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium Openeye Name: butyl-ethyl-[[5-[[(2,4,6-trimethylphenyl)carbamothioylamino]methyl]-2-furyl]methyl]ammonium CAS Name: butyl-ethyl-[[5-[[[sulfanylidene-(2,4,6-trimethylanilino)methyl]amino]methyl]-2-furanyl]methyl]ammonium IUPAC Name: butyl-ethyl-[[5-[[(2,4,6-trimethylphenyl)carbamothioylamino]methyl]furan-2-yl]methyl]azanium Traditional Name: butyl-ethyl-[[5-[(mesitylthiocarbamoylamino)methyl]-2-furyl]methyl]ammonium Formula: C22H34N3OS+ MolecularWeight: 388.58986

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=CC=C(O1)CNC(=S)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCCC[NH+](CC)CC1=CC=C(O1)CNC(=S)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C22H33N3OS/c1-6-8-11-25(7-2)15-20-10-9-19(26-20)14-23-22(27)24-21-17(4)12-16(3)13-18(21)5/h9-10,12-13H,6-8,11,14-15H2,1-5H3,(H2,23,24,27)/p+1