4-[(4-bromophenyl)methoxy]-2-(5-methyl-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide

Systemtic Name: 4-[(4-bromophenyl)methoxy]-2-(5-methyl-2,3-dihydroindol-1-yl)-N-(2-oxidanylideneazepan-3-yl)pyrimidine-5-carboxamide Openeye Name: 4-[(4-bromophenyl)methoxy]-2-(5-methylindolin-1-yl)-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide CAS Name: 4-[(4-bromophenyl)methoxy]-2-(5-methyl-2,3-dihydroindol-1-yl)-N-(2-oxo-3-azepanyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(4-bromophenyl)methoxy]-2-(5-methyl-2,3-dihydroindol-1-yl)-N-(2-oxoazepan-3-yl)pyrimidine-5-carboxamide Traditional Name: 4-(4-bromobenzyl)oxy-N-(2-ketoazepan-3-yl)-2-(5-methylindolin-1-yl)pyrimidine-5-carboxamide Formula: C27H28BrN5O3 MolecularWeight: 550.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC2)C3=NC=C(C(=N3)OCC4=CC=C(C=C4)Br)C(=O)NC5CCCCNC5=O

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC2)C3=NC=C(C(=N3)OCC4=CC=C(C=C4)Br)C(=O)NC5CCCCNC5=O

InChI

InChI=1S/C27H28BrN5O3/c1-17-5-10-23-19(14-17)11-13-33(23)27-30-15-21(24(34)31-22-4-2-3-12-29-25(22)35)26(32-27)36-16-18-6-8-20(28)9-7-18/h5-10,14-15,22H,2-4,11-13,16H2,1H3,(H,29,35)(H,31,34)