3-[1-[[4-(7-methylsulfonyl-3-phenyl-quinoxalin-2-yl)phenyl]methyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[[4-(7-methylsulfonyl-3-phenyl-quinoxalin-2-yl)phenyl]methyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[[4-(7-methylsulfonyl-3-phenyl-quinoxalin-2-yl)phenyl]methyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[[4-(7-methylsulfonyl-3-phenyl-2-quinoxalinyl)phenyl]methyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[[4-(7-methylsulfonyl-3-phenylquinoxalin-2-yl)phenyl]methyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[4-(7-mesyl-3-phenyl-quinoxalin-2-yl)benzyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C34H31N5O3S MolecularWeight: 589.70664

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=C(C=C3)CN4CCC(CC4)N5C6=CC=CC=C6NC5=O)C7=CC=CC=C7

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(C(=N2)C3=CC=C(C=C3)CN4CCC(CC4)N5C6=CC=CC=C6NC5=O)C7=CC=CC=C7

InChI

InChI=1S/C34H31N5O3S/c1-43(41,42)27-15-16-28-30(21-27)36-33(32(35-28)24-7-3-2-4-8-24)25-13-11-23(12-14-25)22-38-19-17-26(18-20-38)39-31-10-6-5-9-29(31)37-34(39)40/h2-16,21,26H,17-20,22H2,1H3,(H,37,40)