5-[(2,5-dimethyl-1-pyridin-4-yl-pyrrol-3-yl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2,5-dimethyl-1-pyridin-4-yl-pyrrol-3-yl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,5-dimethyl-1-pyridin-4-yl-3-pyrrolyl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,5-dimethyl-1-pyridin-4-ylpyrrol-3-yl)methylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=NC=C3)C)C(=O)N(C1=S)CC

Isomeric SMILES

CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=NC=C3)C)C(=O)N(C1=S)CC

InChI

InChI=1S/C20H22N4O2S/c1-5-22-18(25)17(19(26)23(6-2)20(22)27)12-15-11-13(3)24(14(15)4)16-7-9-21-10-8-16/h7-12H,5-6H2,1-4H3