1-[4-(2-quinazolin-4-ylsulfanylethanoyl)phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-(2-quinazolin-4-ylsulfanylethanoyl)phenyl]pyrrolidin-2-one Openeye Name: 1-[4-(2-quinazolin-4-ylsulfanylacetyl)phenyl]pyrrolidin-2-one CAS Name: 1-[4-[1-oxo-2-(4-quinazolinylthio)ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-(2-quinazolin-4-ylsulfanylacetyl)phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(quinazolin-4-ylthio)acetyl]phenyl]-2-pyrrolidone Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C20H17N3O2S/c24-18(12-26-20-16-4-1-2-5-17(16)21-13-22-20)14-7-9-15(10-8-14)23-11-3-6-19(23)25/h1-2,4-5,7-10,13H,3,6,11-12H2