4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2-pyridin-3-yl-quinazoline Openeye Name: 4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2-(3-pyridyl)quinazoline CAS Name: 4-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-2-pyridin-3-ylquinazoline Traditional Name: 4-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)-2-(3-pyridyl)quinazoline Formula: C23H19N5O5S MolecularWeight: 477.49246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O5S/c29-28(30)20-14-17(34(31,32)27-12-3-4-13-27)9-10-21(20)33-23-18-7-1-2-8-19(18)25-22(26-23)16-6-5-11-24-15-16/h1-2,5-11,14-15H,3-4,12-13H2