5-[1-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]ethylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]ethylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[1-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]ethylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[1-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]ethylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[1-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]ethylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-diethyl-5-[1-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)N(C1=S)CC

Isomeric SMILES

CCN1C(=O)C(=C(C)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=O)N(C1=S)CC

InChI

InChI=1S/C21H25N5O3S/c1-6-24-18(27)16(19(28)25(7-2)21(24)30)13(3)22-17-14(4)23(5)26(20(17)29)15-11-9-8-10-12-15/h8-12,22H,6-7H2,1-5H3