N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(7-nitroquinazolin-4-yl)oxy-ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(7-nitroquinazolin-4-yl)oxy-ethanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(7-nitroquinazolin-4-yl)oxy-acetamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[(7-nitro-4-quinazolinyl)oxy]acetamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(7-nitroquinazolin-4-yl)oxyacetamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-(7-nitroquinazolin-4-yl)oxy-acetamide Formula: C21H21N5O7S MolecularWeight: 487.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=NC=NC3=C2C=CC(=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=NC=NC3=C2C=CC(=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21N5O7S/c1-14-2-3-15(10-19(14)34(30,31)25-6-8-32-9-7-25)24-20(27)12-33-21-17-5-4-16(26(28)29)11-18(17)22-13-23-21/h2-5,10-11,13H,6-9,12H2,1H3,(H,24,27)