N-[4-[4-(2-tert-butyl-6-cyclobutyl-pyrimidin-4-yl)piperazin-1-yl]butyl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-[4-(2-tert-butyl-6-cyclobutyl-pyrimidin-4-yl)piperazin-1-yl]butyl]-3-fluoranyl-benzamide Openeye Name: N-[4-[4-(2-tert-butyl-6-cyclobutyl-pyrimidin-4-yl)piperazin-1-yl]butyl]-3-fluoro-benzamide CAS Name: N-[4-[4-(2-tert-butyl-6-cyclobutyl-4-pyrimidinyl)-1-piperazinyl]butyl]-3-fluorobenzamide IUPAC Name: N-[4-[4-(2-tert-butyl-6-cyclobutylpyrimidin-4-yl)piperazin-1-yl]butyl]-3-fluorobenzamide Traditional Name: N-[4-[4-(2-tert-butyl-6-cyclobutyl-pyrimidin-4-yl)piperazino]butyl]-3-fluoro-benzamide Formula: C27H38FN5O MolecularWeight: 467.621923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCCNC(=O)C3=CC(=CC=C3)F)C4CCC4

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CCN(CC2)CCCCNC(=O)C3=CC(=CC=C3)F)C4CCC4

InChI

InChI=1S/C27H38FN5O/c1-27(2,3)26-30-23(20-8-6-9-20)19-24(31-26)33-16-14-32(15-17-33)13-5-4-12-29-25(34)21-10-7-11-22(28)18-21/h7,10-11,18-20H,4-6,8-9,12-17H2,1-3H3,(H,29,34)