5-(1-adamantylamino)-1,2,3-thiadiazole-4-carboxylic acid

Systemtic Name: 5-(1-adamantylamino)-1,2,3-thiadiazole-4-carboxylic acid Openeye Name: 5-(1-adamantylamino)thiadiazole-4-carboxylic acid CAS Name: 5-(1-adamantylamino)-4-thiadiazolecarboxylic acid IUPAC Name: 5-(1-adamantylamino)thiadiazole-4-carboxylic acid Traditional Name: 5-(1-adamantylamino)thiadiazole-4-carboxylic acid Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=C(N=NS4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=C(N=NS4)C(=O)O

InChI

InChI=1S/C13H17N3O2S/c17-12(18)10-11(19-16-15-10)14-13-4-7-1-8(5-13)3-9(2-7)6-13/h7-9,14H,1-6H2,(H,17,18)