5-phenyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one

Systemtic Name: 5-phenyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one Openeye Name: 5-phenyl-2-thioxo-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one CAS Name: 5-phenyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one IUPAC Name: 5-phenyl-2-sulfanylidene-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one Traditional Name: 5-phenyl-2-thioxo-6,7,8,9-tetrahydro-1H-pyrimido[4,5-b]quinolin-4-one Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C(=N2)NC(=S)NC3=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C3C(=N2)NC(=S)NC3=O)C4=CC=CC=C4

InChI

InChI=1S/C17H15N3OS/c21-16-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)18-15(14)19-17(22)20-16/h1-3,6-7H,4-5,8-9H2,(H2,18,19,20,21,22)