N4-(2-aminophenyl)-N1-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N4-(2-aminophenyl)-N1-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzene-1,4-dicarboxamide Openeye Name: N4-(2-aminophenyl)-N1-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]terephthalamide CAS Name: N4-(2-aminophenyl)-N1-[3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 4-N-(2-aminophenyl)-1-N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzene-1,4-dicarboxamide Traditional Name: N'-(2-aminophenyl)-N-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]terephthalamide Formula: C29H23N7O2 MolecularWeight: 501.53862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C29H23N7O2/c30-24-8-1-2-9-26(24)35-28(38)20-12-10-19(11-13-20)27(37)33-22-6-3-7-23(17-22)34-29-32-16-14-25(36-29)21-5-4-15-31-18-21/h1-18H,30H2,(H,33,37)(H,35,38)(H,32,34,36)