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

Systemtic Name: 1-(4-bromophenyl)-6-oxidanyl-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one Openeye Name: 1-(4-bromophenyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(4-bromophenyl)-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-4-pyrimidinone IUPAC Name: 1-(4-bromophenyl)-6-hydroxy-2-sulfanylidene-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4-one Traditional Name: 1-(4-bromophenyl)-6-hydroxy-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)-2-thioxo-pyrimidin-4-one Formula: C19H16BrN3O2S MolecularWeight: 430.31824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrN3O2S/c20-12-5-7-13(8-6-12)23-18(25)15(17(24)22-19(23)26)16-14-4-2-1-3-11(14)9-10-21-16/h1-8,16,21,25H,9-10H2,(H,22,24,26)