1-(2-chloranyl-7H-purin-6-yl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-7H-purin-6-yl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(2-chloro-7H-purin-6-yl)-N-(2-thienylmethyl)piperidine-4-carboxamide CAS Name: 1-(2-chloro-7H-purin-6-yl)-N-(thiophen-2-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-7H-purin-6-yl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-7H-purin-6-yl)-N-(2-thenyl)isonipecotamide Formula: C16H17ClN6OS MolecularWeight: 376.86378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CS2)C3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CS2)C3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C16H17ClN6OS/c17-16-21-13-12(19-9-20-13)14(22-16)23-5-3-10(4-6-23)15(24)18-8-11-2-1-7-25-11/h1-2,7,9-10H,3-6,8H2,(H,18,24)(H,19,20,21,22)