3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-(3-pyrrolidinosulfonylphenyl)propionamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O4S/c26-20(11-10-19-23-18-9-2-1-8-17(18)21(27)24-19)22-15-6-5-7-16(14-15)30(28,29)25-12-3-4-13-25/h1-2,5-9,14H,3-4,10-13H2,(H,22,26)(H,23,24,27)