(E)-N'-[4-(6-azido-2,3-dihydroindol-1-yl)quinazolin-6-yl]-N-(3-morpholin-4-ylpropyl)but-2-enediamide

Systemtic Name: (E)-N'-[4-(6-azido-2,3-dihydroindol-1-yl)quinazolin-6-yl]-N-(3-morpholin-4-ylpropyl)but-2-enediamide Openeye Name: (E)-N'-[4-(6-azidoindolin-1-yl)quinazolin-6-yl]-N-(3-morpholinopropyl)but-2-enediamide CAS Name: (E)-N'-[4-(6-azido-2,3-dihydroindol-1-yl)-6-quinazolinyl]-N-[3-(4-morpholinyl)propyl]-2-butenediamide IUPAC Name: (E)-N'-[4-(6-azido-2,3-dihydroindol-1-yl)quinazolin-6-yl]-N-(3-morpholin-4-ylpropyl)but-2-enediamide Traditional Name: (E)-N'-[4-(6-azidoindolin-1-yl)quinazolin-6-yl]-N-(3-morpholinopropyl)but-2-enediamide Formula: C27H29N9O3 MolecularWeight: 527.57766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=CC(=C2)N=[N+]=[N-])C3=NC=NC4=C3C=C(C=C4)NC(=O)C=CC(=O)NCCCN5CCOCC5

Isomeric SMILES

C1CN(C2=C1C=CC(=C2)N=[N+]=[N-])C3=NC=NC4=C3C=C(C=C4)NC(=O)/C=C/C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C27H29N9O3/c28-34-33-21-3-2-19-8-11-36(24(19)17-21)27-22-16-20(4-5-23(22)30-18-31-27)32-26(38)7-6-25(37)29-9-1-10-35-12-14-39-15-13-35/h2-7,16-18H,1,8-15H2,(H,29,37)(H,32,38)/b7-6+