4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]benzoate

Systemtic Name: 4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]benzoate Openeye Name: 4-[(Z)-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylhydrazono]methyl]benzoate CAS Name: 4-[(Z)-[[[[(2R)-2-oxolanyl]methylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]benzoate IUPAC Name: 4-[(Z)-[[(2R)-oxolan-2-yl]methylcarbamothioylhydrazinylidene]methyl]benzoate Traditional Name: 4-[(Z)-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylhydrazono]methyl]benzoate Formula: C14H16N3O3S- MolecularWeight: 306.36014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NN=CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)N/N=C\C2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H17N3O3S/c18-13(19)11-5-3-10(4-6-11)8-16-17-14(21)15-9-12-2-1-7-20-12/h3-6,8,12H,1-2,7,9H2,(H,18,19)(H2,15,17,21)/p-1/b16-8-/t12-/m1/s1