O-(4-tert-butylphenyl) benzotriazole-1-carbothioate

Systemtic Name: O-(4-tert-butylphenyl) benzotriazole-1-carbothioate Openeye Name: O-(4-tert-butylphenyl) benzotriazole-1-carbothioate CAS Name: 1-benzotriazolecarbothioic acid O-(4-tert-butylphenyl) ester IUPAC Name: O-(4-tert-butylphenyl) benzotriazole-1-carbothioate Traditional Name: benzotriazole-1-carbothioic acid O-(4-tert-butylphenyl) ester Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=S)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=S)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H17N3OS/c1-17(2,3)12-8-10-13(11-9-12)21-16(22)20-15-7-5-4-6-14(15)18-19-20/h4-11H,1-3H3