4-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenyl-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenyl-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenyl-6-(1-piperidyl)pyrimidine CAS Name: 4-[[(4-chlorophenyl)methylthio]methyl]-2-phenyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[(4-chlorophenyl)methylsulfanylmethyl]-2-phenyl-6-piperidin-1-ylpyrimidine Traditional Name: 4-[[(4-chlorobenzyl)thio]methyl]-2-phenyl-6-piperidino-pyrimidine Formula: C23H24ClN3S MolecularWeight: 409.97476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=C2)CSCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=C2)CSCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H24ClN3S/c24-20-11-9-18(10-12-20)16-28-17-21-15-22(27-13-5-2-6-14-27)26-23(25-21)19-7-3-1-4-8-19/h1,3-4,7-12,15H,2,5-6,13-14,16-17H2