2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-nitro-4-oxo-quinazolin-3-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(6-nitro-4-oxo-3-quinazolinyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-nitro-4-oxoquinazolin-3-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-keto-6-nitro-quinazolin-3-yl)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C20H19N5O6S MolecularWeight: 457.45976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O6S/c26-19(12-23-13-21-18-7-6-15(25(28)29)11-17(18)20(23)27)22-14-4-3-5-16(10-14)32(30,31)24-8-1-2-9-24/h3-7,10-11,13H,1-2,8-9,12H2,(H,22,26)