N-[1-[5-[(4,6-diethoxypyrimidin-5-yl)-propyl-amino]-5-oxidanylidene-pentyl]piperidin-4-yl]-2-[4-(trifluoromethyl)phenyl]benzamide

Systemtic Name: N-[1-[5-[(4,6-diethoxypyrimidin-5-yl)-propyl-amino]-5-oxidanylidene-pentyl]piperidin-4-yl]-2-[4-(trifluoromethyl)phenyl]benzamide Openeye Name: N-[1-[5-[(4,6-diethoxypyrimidin-5-yl)-propyl-amino]-5-oxo-pentyl]-4-piperidyl]-2-[4-(trifluoromethyl)phenyl]benzamide CAS Name: N-[1-[5-[(4,6-diethoxy-5-pyrimidinyl)-propylamino]-5-oxopentyl]-4-piperidinyl]-2-[4-(trifluoromethyl)phenyl]benzamide IUPAC Name: N-[1-[5-[(4,6-diethoxypyrimidin-5-yl)-propylamino]-5-oxopentyl]piperidin-4-yl]-2-[4-(trifluoromethyl)phenyl]benzamide Traditional Name: N-[1-[5-[(4,6-diethoxypyrimidin-5-yl)-propyl-amino]-5-keto-pentyl]-4-piperidyl]-2-[4-(trifluoromethyl)phenyl]benzamide Formula: C35H44F3N5O4 MolecularWeight: 655.75017

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N=CN=C1OCC)OCC)C(=O)CCCCN2CCC(CC2)NC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCCN(C1=C(N=CN=C1OCC)OCC)C(=O)CCCCN2CCC(CC2)NC(=O)C3=CC=CC=C3C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C35H44F3N5O4/c1-4-20-43(31-33(46-5-2)39-24-40-34(31)47-6-3)30(44)13-9-10-21-42-22-18-27(19-23-42)41-32(45)29-12-8-7-11-28(29)25-14-16-26(17-15-25)35(36,37)38/h7-8,11-12,14-17,24,27H,4-6,9-10,13,18-23H2,1-3H3,(H,41,45)