3-[6-oxidanylidene-6-(2-pyridin-4-ylpyrrolidin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[6-oxidanylidene-6-(2-pyridin-4-ylpyrrolidin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[6-oxo-6-[2-(4-pyridyl)pyrrolidin-1-yl]hexyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[6-oxo-6-(2-pyridin-4-yl-1-pyrrolidinyl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[6-oxo-6-(2-pyridin-4-ylpyrrolidin-1-yl)hexyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[6-keto-6-[2-(4-pyridyl)pyrrolidino]hexyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=NC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=NC=C4

InChI

InChI=1S/C23H26N4O2S/c28-21(26-16-6-9-20(26)17-11-13-24-14-12-17)10-2-1-5-15-27-22(29)18-7-3-4-8-19(18)25-23(27)30/h3-4,7-8,11-14,20H,1-2,5-6,9-10,15-16H2,(H,25,30)