2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(7-nitro-4-oxo-quinazolin-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(7-nitro-4-oxo-3-quinazolinyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(7-nitro-4-oxoquinazolin-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-keto-7-nitro-quinazolin-3-yl)-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C20H19N5O6S MolecularWeight: 457.45976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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