5-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H13N5O2S MolecularWeight: 375.40382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C4C(=O)NC(=S)NC4=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C4C(=O)NC(=S)NC4=O

InChI

InChI=1S/C19H13N5O2S/c25-17-15(18(26)22-19(27)21-17)9-13-11-24(14-6-2-1-3-7-14)23-16(13)12-5-4-8-20-10-12/h1-11H,(H2,21,22,25,26,27)