13-cyclohexyl-3-methoxy-6-(2-methyl-4-morpholin-4-ylcarbonyl-pyrazol-3-yl)-N-morpholin-4-ylsulfonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide

Systemtic Name: 13-cyclohexyl-3-methoxy-6-(2-methyl-4-morpholin-4-ylcarbonyl-pyrazol-3-yl)-N-morpholin-4-ylsulfonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Openeye Name: 13-cyclohexyl-3-methoxy-6-[2-methyl-4-(morpholine-4-carbonyl)pyrazol-3-yl]-N-morpholinosulfonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide CAS Name: 13-cyclohexyl-3-methoxy-6-[2-methyl-4-[4-morpholinyl(oxo)methyl]-3-pyrazolyl]-N-(4-morpholinylsulfonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide IUPAC Name: 13-cyclohexyl-3-methoxy-6-[2-methyl-4-(morpholine-4-carbonyl)pyrazol-3-yl]-N-morpholin-4-ylsulfonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Traditional Name: 13-cyclohexyl-3-methoxy-6-[2-methyl-4-(morpholine-4-carbonyl)pyrazol-3-yl]-N-morpholinosulfonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxamide Formula: C38H44N6O7S MolecularWeight: 728.85696

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)N2CCOCC2)C3=CC4=C(C=CC(=C4)OC)C5=C(C6=C(N5C3)C=C(C=C6)C(=O)NS(=O)(=O)N7CCOCC7)C8CCCCC8

Isomeric SMILES

CN1C(=C(C=N1)C(=O)N2CCOCC2)C3=CC4=C(C=CC(=C4)OC)C5=C(C6=C(N5C3)C=C(C=C6)C(=O)NS(=O)(=O)N7CCOCC7)C8CCCCC8

InChI

InChI=1S/C38H44N6O7S/c1-41-35(32(23-39-41)38(46)42-12-16-50-17-13-42)28-20-27-21-29(49-2)9-11-30(27)36-34(25-6-4-3-5-7-25)31-10-8-26(22-33(31)44(36)24-28)37(45)40-52(47,48)43-14-18-51-19-15-43/h8-11,20-23,25H,3-7,12-19,24H2,1-2H3,(H,40,45)