N-[5-(7H-purin-6-ylsulfanyl)-1,3,4-thiadiazol-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[5-(7H-purin-6-ylsulfanyl)-1,3,4-thiadiazol-2-yl]morpholine-4-carboxamide Openeye Name: N-[5-(7H-purin-6-ylsulfanyl)-1,3,4-thiadiazol-2-yl]morpholine-4-carboxamide CAS Name: N-[5-(7H-purin-6-ylthio)-1,3,4-thiadiazol-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[5-(7H-purin-6-ylsulfanyl)-1,3,4-thiadiazol-2-yl]morpholine-4-carboxamide Traditional Name: N-[5-(7H-purin-6-ylthio)-1,3,4-thiadiazol-2-yl]morpholine-4-carboxamide Formula: C12H12N8O2S2 MolecularWeight: 364.40608

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)NC2=NN=C(S2)SC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1COCCN1C(=O)NC2=NN=C(S2)SC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C12H12N8O2S2/c21-11(20-1-3-22-4-2-20)17-10-18-19-12(24-10)23-9-7-8(14-5-13-7)15-6-16-9/h5-6H,1-4H2,(H,17,18,21)(H,13,14,15,16)