4-(benzimidazol-1-yl)-N-[[1-(phenylsulfonyl)piperidin-3-yl]methyl]pyrimidin-2-amine

Systemtic Name: 4-(benzimidazol-1-yl)-N-[[1-(phenylsulfonyl)piperidin-3-yl]methyl]pyrimidin-2-amine Openeye Name: N-[[1-(benzenesulfonyl)-3-piperidyl]methyl]-4-(benzimidazol-1-yl)pyrimidin-2-amine CAS Name: N-[[1-(benzenesulfonyl)-3-piperidinyl]methyl]-4-(1-benzimidazolyl)-2-pyrimidinamine IUPAC Name: N-[[1-(benzenesulfonyl)piperidin-3-yl]methyl]-4-(benzimidazol-1-yl)pyrimidin-2-amine Traditional Name: [4-(benzimidazol-1-yl)pyrimidin-2-yl]-[(1-besyl-3-piperidyl)methyl]amine Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)CNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)CNC3=NC=CC(=N3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C23H24N6O2S/c30-32(31,19-8-2-1-3-9-19)28-14-6-7-18(16-28)15-25-23-24-13-12-22(27-23)29-17-26-20-10-4-5-11-21(20)29/h1-5,8-13,17-18H,6-7,14-16H2,(H,24,25,27)