(3S)-1-(2-chloranyl-7H-purin-6-yl)-N-(2-dimethylaminoethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2-chloranyl-7H-purin-6-yl)-N-(2-dimethylaminoethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2-chloro-7H-purin-6-yl)-N-(2-dimethylaminoethyl)piperidine-3-carboxamide CAS Name: (3S)-1-(2-chloro-7H-purin-6-yl)-N-(2-dimethylaminoethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2-chloro-7H-purin-6-yl)-N-(2-dimethylaminoethyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(2-chloro-7H-purin-6-yl)-N-(2-dimethylaminoethyl)nipecotamide Formula: C15H22ClN7O MolecularWeight: 351.83448

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1CCCN(C1)C2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

CN(C)CCNC(=O)[C@H]1CCCN(C1)C2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C15H22ClN7O/c1-22(2)7-5-17-14(24)10-4-3-6-23(8-10)13-11-12(19-9-18-11)20-15(16)21-13/h9-10H,3-8H2,1-2H3,(H,17,24)(H,18,19,20,21)/t10-/m0/s1