13-cyclohexyl-N-(dimethylsulfamoyl)-6-(4-pyrimidin-2-yloxypiperidin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide

Systemtic Name: 13-cyclohexyl-N-(dimethylsulfamoyl)-6-(4-pyrimidin-2-yloxypiperidin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Openeye Name: 13-cyclohexyl-N-(dimethylsulfamoyl)-6-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide CAS Name: 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[oxo-[4-(2-pyrimidinyloxy)-1-piperidinyl]methyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide IUPAC Name: 13-cyclohexyl-N-(dimethylsulfamoyl)-6-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Traditional Name: 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-pyrimidyloxy)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Formula: C36H40N6O5S MolecularWeight: 668.805

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)NC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=CC=CC=C43)C(=O)N5CCC(CC5)OC6=NC=CC=N6)C7CCCCC7

Isomeric SMILES

CN(C)S(=O)(=O)NC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=CC=CC=C43)C(=O)N5CCC(CC5)OC6=NC=CC=N6)C7CCCCC7

InChI

InChI=1S/C36H40N6O5S/c1-40(2)48(45,46)39-34(43)26-13-14-30-31(22-26)42-23-27(35(44)41-19-15-28(16-20-41)47-36-37-17-8-18-38-36)21-25-11-6-7-12-29(25)33(42)32(30)24-9-4-3-5-10-24/h6-8,11-14,17-18,21-22,24,28H,3-5,9-10,15-16,19-20,23H2,1-2H3,(H,39,43)