(5Z)-1-ethyl-6-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-1-ethyl-6-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-5-[(1-benzylindol-3-yl)methylene]-1-ethyl-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-1-ethyl-6-oxo-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(1-benzylindol-3-yl)methylidene]-1-ethyl-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-5-[(1-benzylindol-3-yl)methylene]-1-ethyl-6-keto-2-thioxo-pyrimidin-4-olate Formula: C22H18N3O2S- MolecularWeight: 388.46222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)C(=NC1=S)[O-]

Isomeric SMILES

CCN1C(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)/C(=NC1=S)[O-]

InChI

InChI=1S/C22H19N3O2S/c1-2-25-21(27)18(20(26)23-22(25)28)12-16-14-24(13-15-8-4-3-5-9-15)19-11-7-6-10-17(16)19/h3-12,14H,2,13H2,1H3,(H,23,26,28)/p-1/b18-12-