2-[4-chloranyl-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-chloranyl-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-2-yl]sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(4-benzyl-1-piperidyl)-6-chloro-pyrimidin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[4-chloro-6-[4-(phenylmethyl)-1-piperidinyl]-2-pyrimidinyl]thio]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(4-benzylpiperidin-1-yl)-6-chloropyrimidin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: N-benzyl-2-[[4-(4-benzylpiperidino)-6-chloro-pyrimidin-2-yl]thio]-N-phenethyl-acetamide Formula: C33H35ClN4OS MolecularWeight: 571.1752

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=CC(=NC(=N3)SCC(=O)N(CCC4=CC=CC=C4)CC5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=CC(=NC(=N3)SCC(=O)N(CCC4=CC=CC=C4)CC5=CC=CC=C5)Cl

InChI

InChI=1S/C33H35ClN4OS/c34-30-23-31(37-19-17-28(18-20-37)22-27-12-6-2-7-13-27)36-33(35-30)40-25-32(39)38(24-29-14-8-3-9-15-29)21-16-26-10-4-1-5-11-26/h1-15,23,28H,16-22,24-25H2