diethyl-[2-[2-(3-ethyl-4-sulfanylidene-phthalazin-1-yl)ethanoylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[2-(3-ethyl-4-sulfanylidene-phthalazin-1-yl)ethanoylamino]ethyl]azanium Openeye Name: diethyl-[2-[[2-(3-ethyl-4-thioxo-phthalazin-1-yl)acetyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[[2-(3-ethyl-4-sulfanylidene-1-phthalazinyl)-1-oxoethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[[2-(3-ethyl-4-sulfanylidenephthalazin-1-yl)acetyl]amino]ethyl]azanium Traditional Name: diethyl-[2-[[2-(3-ethyl-4-thioxo-phthalazin-1-yl)acetyl]amino]ethyl]ammonium Formula: C18H27N4OS+ MolecularWeight: 347.49818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=S)C2=CC=CC=C2C(=N1)CC(=O)NCC[NH+](CC)CC

Isomeric SMILES

CCN1C(=S)C2=CC=CC=C2C(=N1)CC(=O)NCC[NH+](CC)CC

InChI

InChI=1S/C18H26N4OS/c1-4-21(5-2)12-11-19-17(23)13-16-14-9-7-8-10-15(14)18(24)22(6-3)20-16/h7-10H,4-6,11-13H2,1-3H3,(H,19,23)/p+1