5-[(2-methyl-5-pyrrolidin-1-yl-pyrazolo[1,5-a]quinazolin-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2-methyl-5-pyrrolidin-1-yl-pyrazolo[1,5-a]quinazolin-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-methyl-5-pyrrolidin-1-yl-pyrazolo[1,5-a]quinazolin-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-methyl-5-(1-pyrrolidinyl)-3-pyrazolo[1,5-a]quinazolinyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-methyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]quinazolin-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2-methyl-5-pyrrolidino-pyrazolo[1,5-a]quinazolin-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1C=C4C(=O)NC(=S)NC4=O)N5CCCC5

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1C=C4C(=O)NC(=S)NC4=O)N5CCCC5

InChI

InChI=1S/C20H18N6O2S/c1-11-13(10-14-18(27)22-20(29)23-19(14)28)17-21-16(25-8-4-5-9-25)12-6-2-3-7-15(12)26(17)24-11/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,22,23,27,28,29)