5-tert-butyl-3-(6-chloranyl-2-oxidanylidene-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one

Systemtic Name: 5-tert-butyl-3-(6-chloranyl-2-oxidanylidene-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Openeye Name: 5-tert-butyl-3-(6-chloro-2-oxo-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one CAS Name: 5-tert-butyl-3-(6-chloro-2-oxo-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one IUPAC Name: 5-tert-butyl-3-(6-chloro-2-oxo-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Traditional Name: 5-tert-butyl-3-(6-chloro-2-keto-3H-1,3-benzothiazol-5-yl)-1,3,4-oxadiazol-2-one Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)O1)C2=C(C=C3C(=C2)NC(=O)S3)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)O1)C2=C(C=C3C(=C2)NC(=O)S3)Cl

InChI

InChI=1S/C13H12ClN3O3S/c1-13(2,3)10-16-17(12(19)20-10)8-5-7-9(4-6(8)14)21-11(18)15-7/h4-5H,1-3H3,(H,15,18)