[[(2S)-4-(phenylmethyl)morpholin-2-yl]methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [[(2S)-4-(phenylmethyl)morpholin-2-yl]methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [[(2S)-4-benzylmorpholin-2-yl]methylamino]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [[(2S)-4-(phenylmethyl)-2-morpholinyl]methylamino]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [[(2S)-4-benzylmorpholin-2-yl]methylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [[(2S)-4-benzylmorpholin-2-yl]methylamino]-(2-thioxo-3-pyridylidene)methanolate Formula: C18H20N3O2S- MolecularWeight: 342.4353

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1CC2=CC=CC=C2)CNC(=C3C=CC=NC3=S)[O-]

Isomeric SMILES

C1CO[C@H](CN1CC2=CC=CC=C2)CNC(=C3C=CC=NC3=S)[O-]

InChI

InChI=1S/C18H21N3O2S/c22-17(16-7-4-8-19-18(16)24)20-11-15-13-21(9-10-23-15)12-14-5-2-1-3-6-14/h1-8,15,20,22H,9-13H2/p-1/t15-/m0/s1