5-phenyl-2-sulfanylidene-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione

Systemtic Name: 5-phenyl-2-sulfanylidene-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione Openeye Name: 5-phenyl-2-thioxo-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione CAS Name: 5-phenyl-2-sulfanylidene-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione IUPAC Name: 5-phenyl-2-sulfanylidene-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-dione Traditional Name: 5-phenyl-2-thioxo-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6-quinone Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(N2)NC(=S)NC3=O)C4=CC=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(N2)NC(=S)NC3=O)C4=CC=CC=C4)C(=O)C1

InChI

InChI=1S/C17H15N3O2S/c21-11-8-4-7-10-13(11)12(9-5-2-1-3-6-9)14-15(18-10)19-17(23)20-16(14)22/h1-3,5-6,12H,4,7-8H2,(H3,18,19,20,22,23)