[[(2S)-2-(4-chlorophenyl)-2-oxidanyl-ethyl]amino]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [[(2S)-2-(4-chlorophenyl)-2-oxidanyl-ethyl]amino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [[(2S)-2-(4-chlorophenyl)-2-hydroxy-ethyl]amino]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [[(2S)-2-(4-chlorophenyl)-2-hydroxyethyl]amino]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [[(2S)-2-(4-chlorophenyl)-2-hydroxyethyl]amino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [[(2S)-2-(4-chlorophenyl)-2-hydroxy-ethyl]amino]-(2-thioxo-3-pyridylidene)methanolate Formula: C14H12ClN2O2S- MolecularWeight: 307.77528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(NCC(C2=CC=C(C=C2)Cl)O)[O-])C(=S)N=C1

Isomeric SMILES

C1=CC(=C(NC[C@H](C2=CC=C(C=C2)Cl)O)[O-])C(=S)N=C1

InChI

InChI=1S/C14H13ClN2O2S/c15-10-5-3-9(4-6-10)12(18)8-17-13(19)11-2-1-7-16-14(11)20/h1-7,12,17-19H,8H2/p-1/t12-/m1/s1