6-bromanyl-3-[6-oxidanylidene-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[6-oxidanylidene-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-[6-oxo-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[6-oxo-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-[6-oxo-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-[6-keto-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)hexyl]-2-thioxo-1H-quinazolin-4-one Formula: C25H26BrN3O2S MolecularWeight: 512.46184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

InChI

InChI=1S/C25H26BrN3O2S/c26-20-10-11-22-21(17-20)24(31)29(25(32)27-22)14-6-2-5-9-23(30)28-15-12-19(13-16-28)18-7-3-1-4-8-18/h1,3-4,7-8,10-12,17H,2,5-6,9,13-16H2,(H,27,32)