(5Z)-5-[[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5Z)-5-[[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-6-oxidanylidene-1-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5Z)-1-allyl-5-[[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5Z)-5-[[1-(4-dimethylaminophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5Z)-5-[[1-(4-dimethylaminophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-6-oxo-1-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5Z)-1-allyl-5-[[1-(4-dimethylaminophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-6-keto-2-thioxo-pyrimidin-4-olate Formula: C22H23N4O2S- MolecularWeight: 407.50862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)N(C)C)C)C=C3C(=NC(=S)N(C3=O)CC=C)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)N(C)C)C)/C=C\3/C(=NC(=S)N(C3=O)CC=C)[O-]

InChI

InChI=1S/C22H24N4O2S/c1-6-11-25-21(28)19(20(27)23-22(25)29)13-16-12-14(2)26(15(16)3)18-9-7-17(8-10-18)24(4)5/h6-10,12-13H,1,11H2,2-5H3,(H,23,27,29)/p-1/b19-13-