N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)-1H-pyrimidin-6-yl]ethanamide

Systemtic Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-5-(pyrimidin-5-ylmethyl)-1H-pyrimidin-6-yl]ethanamide Openeye Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)-1H-pyrimidin-6-yl]acetamide CAS Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylthio]-4-oxo-5-(5-pyrimidinylmethyl)-1H-pyrimidin-6-yl]acetamide IUPAC Name: N,N-dibutyl-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-5-(pyrimidin-5-ylmethyl)-1H-pyrimidin-6-yl]acetamide Traditional Name: N,N-dibutyl-2-[2-[(4-fluorobenzyl)thio]-4-keto-5-(5-pyrimidylmethyl)-1H-pyrimidin-6-yl]acetamide Formula: C26H32FN5O2S MolecularWeight: 497.627983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

Isomeric SMILES

CCCCN(CCCC)C(=O)CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CN=CN=C3

InChI

InChI=1S/C26H32FN5O2S/c1-3-5-11-32(12-6-4-2)24(33)14-23-22(13-20-15-28-18-29-16-20)25(34)31-26(30-23)35-17-19-7-9-21(27)10-8-19/h7-10,15-16,18H,3-6,11-14,17H2,1-2H3,(H,30,31,34)