4-[(2-dimethylaminoethylamino)-fluoranyl-methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

Systemtic Name: 4-[(2-dimethylaminoethylamino)-fluoranyl-methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 4-[(2-dimethylaminoethylamino)-fluoro-methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide CAS Name: 4-[(2-dimethylaminoethylamino)-fluoromethyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 4-[(2-dimethylaminoethylamino)-fluoromethyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 4-[(2-dimethylaminoethylamino)-fluoro-methyl]-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]benzamide Formula: C28H30FN7O MolecularWeight: 499.582503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C(NCCN(C)C)F)NC3=NC=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C(NCCN(C)C)F)NC3=NC=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C28H30FN7O/c1-19-6-11-23(17-25(19)35-28-32-14-12-24(34-28)22-5-4-13-30-18-22)33-27(37)21-9-7-20(8-10-21)26(29)31-15-16-36(2)3/h4-14,17-18,26,31H,15-16H2,1-3H3,(H,33,37)(H,32,34,35)