3-[(4-tert-butylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(4-tert-butylphenyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(4-tert-butylphenyl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H19N3OS/c1-18(2,3)13-8-10-14(11-9-13)23-12-21-17(22)15-6-4-5-7-16(15)19-20-21/h4-11H,12H2,1-3H3