(4-azanylquinazolin-2-yl)methyl (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enoate Openeye Name: (4-aminoquinazolin-2-yl)methyl (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-propenoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]acrylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C25H22N4O5S/c1-33-19-11-9-18(10-12-19)29-35(31,32)20-13-6-17(7-14-20)8-15-24(30)34-16-23-27-22-5-3-2-4-21(22)25(26)28-23/h2-15,29H,16H2,1H3,(H2,26,27,28)/b15-8+