2-[3-[(Z)-C-methyl-N-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]carbonimidoyl]phenoxy]ethanoate

Systemtic Name: 2-[3-[(Z)-C-methyl-N-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[3-[(Z)-C-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylamino]carbonimidoyl]phenoxy]acetate CAS Name: 2-[3-[(1Z)-1-[[[[(2R)-2-oxolanyl]methylamino]-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetate IUPAC Name: 2-[3-[(Z)-C-methyl-N-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]carbonimidoyl]phenoxy]acetate Traditional Name: 2-[3-[(Z)-C-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylamino]carbonimidoyl]phenoxy]acetate Formula: C16H20N3O4S- MolecularWeight: 350.4127

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1CCCO1)C2=CC(=CC=C2)OCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NC[C@H]1CCCO1)/C2=CC(=CC=C2)OCC(=O)[O-]

InChI

InChI=1S/C16H21N3O4S/c1-11(12-4-2-5-13(8-12)23-10-15(20)21)18-19-16(24)17-9-14-6-3-7-22-14/h2,4-5,8,14H,3,6-7,9-10H2,1H3,(H,20,21)(H2,17,19,24)/p-1/b18-11-/t14-/m1/s1