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

Systemtic Name: (5Z)-6-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-allyl-5-[(1-benzylindol-3-yl)methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-6-oxo-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[(1-benzylindol-3-yl)methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-1-allyl-5-[(1-benzylindol-3-yl)methylene]-6-keto-2-thioxo-pyrimidin-4-olate Formula: C23H18N3O2S- MolecularWeight: 400.47292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O2S/c1-2-12-26-22(28)19(21(27)24-23(26)29)13-17-15-25(14-16-8-4-3-5-9-16)20-11-7-6-10-18(17)20/h2-11,13,15H,1,12,14H2,(H,24,27,29)/p-1/b19-13-