N-[5-[4-(2,2-dimethylpropylcarbamoyl)phenyl]-6-methyl-pyridin-3-yl]-3-fluoranyl-5-morpholin-4-yl-benzamide

Systemtic Name: N-[5-[4-(2,2-dimethylpropylcarbamoyl)phenyl]-6-methyl-pyridin-3-yl]-3-fluoranyl-5-morpholin-4-yl-benzamide Openeye Name: N-[5-[4-(2,2-dimethylpropylcarbamoyl)phenyl]-6-methyl-3-pyridyl]-3-fluoro-5-morpholino-benzamide CAS Name: N-[5-[4-[(2,2-dimethylpropylamino)-oxomethyl]phenyl]-6-methyl-3-pyridinyl]-3-fluoro-5-(4-morpholinyl)benzamide IUPAC Name: N-[5-[4-(2,2-dimethylpropylcarbamoyl)phenyl]-6-methylpyridin-3-yl]-3-fluoro-5-morpholin-4-ylbenzamide Traditional Name: 3-fluoro-N-[6-methyl-5-[4-(neopentylcarbamoyl)phenyl]-3-pyridyl]-5-morpholino-benzamide Formula: C29H33FN4O3 MolecularWeight: 504.595723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C2=CC=C(C=C2)C(=O)NCC(C)(C)C)NC(=O)C3=CC(=CC(=C3)F)N4CCOCC4

Isomeric SMILES

CC1=NC=C(C=C1C2=CC=C(C=C2)C(=O)NCC(C)(C)C)NC(=O)C3=CC(=CC(=C3)F)N4CCOCC4

InChI

InChI=1S/C29H33FN4O3/c1-19-26(20-5-7-21(8-6-20)27(35)32-18-29(2,3)4)16-24(17-31-19)33-28(36)22-13-23(30)15-25(14-22)34-9-11-37-12-10-34/h5-8,13-17H,9-12,18H2,1-4H3,(H,32,35)(H,33,36)