[1-(6-chloranyl-2-methylsulfanyl-5-phenyl-pyrimidin-4-yl)piperidin-4-yl]-diphenyl-methanol

Systemtic Name: [1-(6-chloranyl-2-methylsulfanyl-5-phenyl-pyrimidin-4-yl)piperidin-4-yl]-diphenyl-methanol Openeye Name: [1-(6-chloro-2-methylsulfanyl-5-phenyl-pyrimidin-4-yl)-4-piperidyl]-diphenyl-methanol CAS Name: [1-[6-chloro-2-(methylthio)-5-phenyl-4-pyrimidinyl]-4-piperidinyl]-diphenylmethanol IUPAC Name: [1-(6-chloro-2-methylsulfanyl-5-phenylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol Traditional Name: [1-[6-chloro-2-(methylthio)-5-phenyl-pyrimidin-4-yl]-4-piperidyl]-diphenyl-methanol Formula: C29H28ClN3OS MolecularWeight: 502.07012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)Cl)C2=CC=CC=C2)N3CCC(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

CSC1=NC(=C(C(=N1)Cl)C2=CC=CC=C2)N3CCC(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C29H28ClN3OS/c1-35-28-31-26(30)25(21-11-5-2-6-12-21)27(32-28)33-19-17-24(18-20-33)29(34,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,24,34H,17-20H2,1H3