5-chloranyl-N-[1-(7H-purin-6-yl)piperidin-3-yl]-2,3-dihydroindole-1-carboxamide

Systemtic Name: 5-chloranyl-N-[1-(7H-purin-6-yl)piperidin-3-yl]-2,3-dihydroindole-1-carboxamide Openeye Name: 5-chloro-N-[1-(7H-purin-6-yl)-3-piperidyl]indoline-1-carboxamide CAS Name: 5-chloro-N-[1-(7H-purin-6-yl)-3-piperidinyl]-2,3-dihydroindole-1-carboxamide IUPAC Name: 5-chloro-N-[1-(7H-purin-6-yl)piperidin-3-yl]-2,3-dihydroindole-1-carboxamide Traditional Name: 5-chloro-N-[1-(7H-purin-6-yl)-3-piperidyl]indoline-1-carboxamide Formula: C19H20ClN7O MolecularWeight: 397.8614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=NC3=C2NC=N3)NC(=O)N4CCC5=C4C=CC(=C5)Cl

Isomeric SMILES

C1CC(CN(C1)C2=NC=NC3=C2NC=N3)NC(=O)N4CCC5=C4C=CC(=C5)Cl

InChI

InChI=1S/C19H20ClN7O/c20-13-3-4-15-12(8-13)5-7-27(15)19(28)25-14-2-1-6-26(9-14)18-16-17(22-10-21-16)23-11-24-18/h3-4,8,10-11,14H,1-2,5-7,9H2,(H,25,28)(H,21,22,23,24)