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

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-6-(1-piperidyl)pyrimidine CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-2-phenyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-2-phenyl-6-piperidin-1-ylpyrimidine Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-2-phenyl-6-piperidino-pyrimidine Formula: C22H22ClN3S MolecularWeight: 395.94818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=C2)CSC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=C2)CSC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H22ClN3S/c23-18-9-11-20(12-10-18)27-16-19-15-21(26-13-5-2-6-14-26)25-22(24-19)17-7-3-1-4-8-17/h1,3-4,7-12,15H,2,5-6,13-14,16H2