dimethyl-[(1S)-1-phenyl-2-(2,4,4-trimethylpentan-2-ylcarbamothioylamino)ethyl]azanium

Systemtic Name: dimethyl-[(1S)-1-phenyl-2-(2,4,4-trimethylpentan-2-ylcarbamothioylamino)ethyl]azanium Openeye Name: dimethyl-[(1S)-1-phenyl-2-(1,1,3,3-tetramethylbutylcarbamothioylamino)ethyl]ammonium CAS Name: dimethyl-[(1S)-1-phenyl-2-[[sulfanylidene-(2,4,4-trimethylpentan-2-ylamino)methyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-phenyl-2-(2,4,4-trimethylpentan-2-ylcarbamothioylamino)ethyl]azanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-(1,1,3,3-tetramethylbutylthiocarbamoylamino)ethyl]ammonium Formula: C19H34N3S+ MolecularWeight: 336.55836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=S)NCC(C1=CC=CC=C1)[NH+](C)C

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=S)NC[C@H](C1=CC=CC=C1)[NH+](C)C

InChI

InChI=1S/C19H33N3S/c1-18(2,3)14-19(4,5)21-17(23)20-13-16(22(6)7)15-11-9-8-10-12-15/h8-12,16H,13-14H2,1-7H3,(H2,20,21,23)/p+1/t16-/m1/s1