1-(2-chloranyl-7H-purin-6-yl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-(2-chloranyl-7H-purin-6-yl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-(2-chloro-7H-purin-6-yl)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-(2-chloro-7H-purin-6-yl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: 1-(2-chloro-7H-purin-6-yl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-(2-chloro-7H-purin-6-yl)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C16H19ClN8OS MolecularWeight: 406.89306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2CCCN(C2)C3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2CCCN(C2)C3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C16H19ClN8OS/c1-8(2)14-23-24-16(27-14)22-13(26)9-4-3-5-25(6-9)12-10-11(19-7-18-10)20-15(17)21-12/h7-9H,3-6H2,1-2H3,(H,22,24,26)(H,18,19,20,21)