6-oxidanyl-1-phenyl-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one

Systemtic Name: 6-oxidanyl-1-phenyl-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one Openeye Name: 6-hydroxy-1-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-pyrimidin-4-one CAS Name: 6-hydroxy-1-phenyl-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-4-pyrimidinone IUPAC Name: 6-hydroxy-1-phenyl-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one Traditional Name: 6-hydroxy-1-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-pyrimidin-4-one Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC=CC=C21)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)O

Isomeric SMILES

C1CNC(C2=CC=CC=C21)C3=C(N(C(=S)NC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C19H17N3O2S/c23-17-15(16-14-9-5-4-6-12(14)10-11-20-16)18(24)22(19(25)21-17)13-7-2-1-3-8-13/h1-9,16,20,24H,10-11H2,(H,21,23,25)