N-[5-(9-methylpurin-6-yl)sulfanyl-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[5-(9-methylpurin-6-yl)sulfanyl-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[5-(9-methylpurin-6-yl)sulfanyl-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide CAS Name: N-[5-[(9-methyl-6-purinyl)thio]-1,3,4-thiadiazol-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[5-(9-methylpurin-6-yl)sulfanyl-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[5-[(9-methylpurin-6-yl)thio]-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide Formula: C13H9N7OS3 MolecularWeight: 375.45186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2SC3=NN=C(S3)NC(=O)C4=CC=CS4

Isomeric SMILES

CN1C=NC2=C1N=CN=C2SC3=NN=C(S3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C13H9N7OS3/c1-20-6-16-8-9(20)14-5-15-11(8)23-13-19-18-12(24-13)17-10(21)7-3-2-4-22-7/h2-6H,1H3,(H,17,18,21)