N-methyl-2-[4-oxidanylidene-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-methyl-2-[4-oxidanylidene-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-methyl-2-[4-oxo-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-methyl-2-[[4-oxo-3-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-quinazolinyl]thio]propanamide IUPAC Name: N-methyl-2-[4-oxo-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-2-yl]sulfanylpropanamide Traditional Name: 2-[[4-keto-3-(3-pyrrolidinosulfonylphenyl)quinazolin-2-yl]thio]-N-methyl-propionamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(C(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H24N4O4S2/c1-15(20(27)23-2)31-22-24-19-11-4-3-10-18(19)21(28)26(22)16-8-7-9-17(14-16)32(29,30)25-12-5-6-13-25/h3-4,7-11,14-15H,5-6,12-13H2,1-2H3,(H,23,27)