2-[[2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinazolin-4-yl]amino]ethanoic acid

Systemtic Name: 2-[[2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinazolin-4-yl]amino]ethanoic acid Openeye Name: 2-[[2-[4-(p-tolylsulfonylamino)phenyl]quinazolin-4-yl]amino]acetic acid CAS Name: 2-[[2-[4-[(4-methylphenyl)sulfonylamino]phenyl]-4-quinazolinyl]amino]acetic acid IUPAC Name: 2-[[2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinazolin-4-yl]amino]acetic acid Traditional Name: 2-[[2-[4-(tosylamino)phenyl]quinazolin-4-yl]amino]acetic acid Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=N3)NCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=N3)NCC(=O)O

InChI

InChI=1S/C23H20N4O4S/c1-15-6-12-18(13-7-15)32(30,31)27-17-10-8-16(9-11-17)22-25-20-5-3-2-4-19(20)23(26-22)24-14-21(28)29/h2-13,27H,14H2,1H3,(H,28,29)(H,24,25,26)