diethyl-[2-[4-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]phenyl]carbonyloxyethyl]azanium

Systemtic Name: diethyl-[2-[4-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]phenyl]carbonyloxyethyl]azanium Openeye Name: diethyl-[2-[4-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylamino]benzoyl]oxyethyl]ammonium CAS Name: diethyl-[2-[oxo-[4-[[[[(2R)-2-oxolanyl]methylamino]-sulfanylidenemethyl]amino]phenyl]methoxy]ethyl]ammonium IUPAC Name: diethyl-[2-[4-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]benzoyl]oxyethyl]azanium Traditional Name: diethyl-[2-[4-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylamino]benzoyl]oxyethyl]ammonium Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2CCCO2

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NC[C@H]2CCCO2

InChI

InChI=1S/C19H29N3O3S/c1-3-22(4-2)11-13-25-18(23)15-7-9-16(10-8-15)21-19(26)20-14-17-6-5-12-24-17/h7-10,17H,3-6,11-14H2,1-2H3,(H2,20,21,26)/p+1/t17-/m1/s1