(2-tert-butyl-5-methylsulfanyl-1,3-benzoxazol-6-yl)carbamodithioic acid

Systemtic Name: (2-tert-butyl-5-methylsulfanyl-1,3-benzoxazol-6-yl)carbamodithioic acid Openeye Name: (2-tert-butyl-5-methylsulfanyl-1,3-benzoxazol-6-yl)carbamodithioic acid CAS Name: [2-tert-butyl-5-(methylthio)-1,3-benzoxazol-6-yl]carbamodithioic acid IUPAC Name: (2-tert-butyl-5-methylsulfanyl-1,3-benzoxazol-6-yl)carbamodithioic acid Traditional Name: [2-tert-butyl-5-(methylthio)-1,3-benzoxazol-6-yl]carbamodithioic acid Formula: C13H16N2OS3 MolecularWeight: 312.47394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2O1)NC(=S)S)SC

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2O1)NC(=S)S)SC

InChI

InChI=1S/C13H16N2OS3/c1-13(2,3)11-14-7-6-10(19-4)8(15-12(17)18)5-9(7)16-11/h5-6H,1-4H3,(H2,15,17,18)