diethyl-[2-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[[(2R)-oxolan-2-yl]methylcarbamothioyl]amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[[(2R)-oxolan-2-yl]methylcarbamothioyl]amino]ethyl]azanium Openeye Name: diethyl-[2-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl-[[[(2R)-2-oxolanyl]methylamino]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl-[[(2R)-oxolan-2-yl]methylcarbamothioyl]amino]ethyl]azanium Traditional Name: diethyl-[2-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoyl]amino]ethyl]ammonium Formula: C23H35N4O2S+ MolecularWeight: 431.6146

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC1=CC2=C(C=CC(=C2)C)NC1=O)C(=S)NCC3CCCO3

Isomeric SMILES

CC[NH+](CC)CCN(CC1=CC2=C(C=CC(=C2)C)NC1=O)C(=S)NC[C@H]3CCCO3

InChI

InChI=1S/C23H34N4O2S/c1-4-26(5-2)10-11-27(23(30)24-15-20-7-6-12-29-20)16-19-14-18-13-17(3)8-9-21(18)25-22(19)28/h8-9,13-14,20H,4-7,10-12,15-16H2,1-3H3,(H,24,30)(H,25,28)/p+1/t20-/m1/s1