N-[(2-methoxy-5-pyrimidin-2-ylsulfonyl-phenyl)methyl]-2-phenyl-piperidin-3-amine

Systemtic Name: N-[(2-methoxy-5-pyrimidin-2-ylsulfonyl-phenyl)methyl]-2-phenyl-piperidin-3-amine Openeye Name: N-[(2-methoxy-5-pyrimidin-2-ylsulfonyl-phenyl)methyl]-2-phenyl-piperidin-3-amine CAS Name: N-[[2-methoxy-5-(2-pyrimidinylsulfonyl)phenyl]methyl]-2-phenyl-3-piperidinamine IUPAC Name: N-[(2-methoxy-5-pyrimidin-2-ylsulfonylphenyl)methyl]-2-phenylpiperidin-3-amine Traditional Name: [2-methoxy-5-(2-pyrimidylsulfonyl)benzyl]-(2-phenyl-3-piperidyl)amine Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C2=NC=CC=N2)CNC3CCCNC3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C2=NC=CC=N2)CNC3CCCNC3C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-30-21-11-10-19(31(28,29)23-25-13-6-14-26-23)15-18(21)16-27-20-9-5-12-24-22(20)17-7-3-2-4-8-17/h2-4,6-8,10-11,13-15,20,22,24,27H,5,9,12,16H2,1H3