3-[[2-(4-methylphenyl)sulfonyl-1H-indol-3-yl]methyl]-6-(2-methylpropyl)-1-oxidanyl-5-phenylmethoxy-pyrazin-2-imine

Systemtic Name: 3-[[2-(4-methylphenyl)sulfonyl-1H-indol-3-yl]methyl]-6-(2-methylpropyl)-1-oxidanyl-5-phenylmethoxy-pyrazin-2-imine Openeye Name: 5-benzyloxy-1-hydroxy-6-isobutyl-3-[[2-(p-tolylsulfonyl)-1H-indol-3-yl]methyl]pyrazin-2-imine CAS Name: 1-hydroxy-3-[[2-(4-methylphenyl)sulfonyl-1H-indol-3-yl]methyl]-6-(2-methylpropyl)-5-phenylmethoxy-2-pyrazinimine IUPAC Name: 1-hydroxy-3-[[2-(4-methylphenyl)sulfonyl-1H-indol-3-yl]methyl]-6-(2-methylpropyl)-5-phenylmethoxypyrazin-2-imine Traditional Name: [5-benzoxy-1-hydroxy-6-isobutyl-3-[(2-tosyl-1H-indol-3-yl)methyl]pyrazin-2-ylidene]amine Formula: C31H32N4O4S MolecularWeight: 556.67518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3N2)CC4=NC(=C(N(C4=N)O)CC(C)C)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3N2)CC4=NC(=C(N(C4=N)O)CC(C)C)OCC5=CC=CC=C5

InChI

InChI=1S/C31H32N4O4S/c1-20(2)17-28-30(39-19-22-9-5-4-6-10-22)33-27(29(32)35(28)36)18-25-24-11-7-8-12-26(24)34-31(25)40(37,38)23-15-13-21(3)14-16-23/h4-16,20,32,34,36H,17-19H2,1-3H3