(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Openeye Name: [4-[1-(4-benzyloxybutyl)imidazol-2-yl]-1-piperidyl]-(5-chloro-2-methylsulfanyl-pyrimidin-4-yl)methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidin-1-yl]methanone Traditional Name: [4-[1-(4-benzoxybutyl)imidazol-2-yl]piperidino]-[5-chloro-2-(methylthio)pyrimidin-4-yl]methanone Formula: C25H30ClN5O2S MolecularWeight: 500.056

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H30ClN5O2S/c1-34-25-28-17-21(26)22(29-25)24(32)31-13-9-20(10-14-31)23-27-11-15-30(23)12-5-6-16-33-18-19-7-3-2-4-8-19/h2-4,7-8,11,15,17,20H,5-6,9-10,12-14,16,18H2,1H3