3-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,3,4-trimethyl-6-oxidanyl-phenyl)propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,3,4-trimethyl-6-oxidanyl-phenyl)propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(6-hydroxy-2,3,4-trimethyl-phenyl)propan-1-one CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-(6-hydroxy-2,3,4-trimethylphenyl)-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(6-hydroxy-2,3,4-trimethylphenyl)propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-(6-hydroxy-2,3,4-trimethyl-phenyl)propan-1-one Formula: C19H19NO2S2 MolecularWeight: 357.48966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C)C(=O)CCSC2=NC3=CC=CC=C3S2)O

Isomeric SMILES

CC1=CC(=C(C(=C1C)C)C(=O)CCSC2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C19H19NO2S2/c1-11-10-16(22)18(13(3)12(11)2)15(21)8-9-23-19-20-14-6-4-5-7-17(14)24-19/h4-7,10,22H,8-9H2,1-3H3