N-[3-[(6-chloranylpyrimidin-4-yl)amino]-4-methyl-phenyl]-3-morpholin-4-yl-benzamide

Systemtic Name: N-[3-[(6-chloranylpyrimidin-4-yl)amino]-4-methyl-phenyl]-3-morpholin-4-yl-benzamide Openeye Name: N-[3-[(6-chloropyrimidin-4-yl)amino]-4-methyl-phenyl]-3-morpholino-benzamide CAS Name: N-[3-[(6-chloro-4-pyrimidinyl)amino]-4-methylphenyl]-3-(4-morpholinyl)benzamide IUPAC Name: N-[3-[(6-chloropyrimidin-4-yl)amino]-4-methylphenyl]-3-morpholin-4-ylbenzamide Traditional Name: N-[3-[(6-chloropyrimidin-4-yl)amino]-4-methyl-phenyl]-3-morpholino-benzamide Formula: C22H22ClN5O2 MolecularWeight: 423.89538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCOCC3)NC4=CC(=NC=N4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCOCC3)NC4=CC(=NC=N4)Cl

InChI

InChI=1S/C22H22ClN5O2/c1-15-5-6-17(12-19(15)27-21-13-20(23)24-14-25-21)26-22(29)16-3-2-4-18(11-16)28-7-9-30-10-8-28/h2-6,11-14H,7-10H2,1H3,(H,26,29)(H,24,25,27)