4-ethoxy-2-(4-methoxy-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide

Systemtic Name: 4-ethoxy-2-(4-methoxy-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide Openeye Name: 4-ethoxy-2-(4-methoxyindolin-1-yl)-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide CAS Name: 4-ethoxy-2-(4-methoxy-2,3-dihydroindol-1-yl)-N-(2-oxo-3-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 4-ethoxy-2-(4-methoxy-2,3-dihydroindol-1-yl)-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide Traditional Name: 4-ethoxy-N-(2-ketoazepan-3-yl)-2-(4-methoxyindolin-1-yl)pyrimidine-5-carboxamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1C(=O)NC2CCCCNC2=O)N3CCC4=C3C=CC=C4OC

Isomeric SMILES

CCOC1=NC(=NC=C1C(=O)NC2CCCCNC2=O)N3CCC4=C3C=CC=C4OC

InChI

InChI=1S/C22H27N5O4/c1-3-31-21-15(19(28)25-16-7-4-5-11-23-20(16)29)13-24-22(26-21)27-12-10-14-17(27)8-6-9-18(14)30-2/h6,8-9,13,16H,3-5,7,10-12H2,1-2H3,(H,23,29)(H,25,28)