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2-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)isoindole-1,3-dione

2-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)isoindole-1,3-dione

Systemtic Name:2-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)isoindole-1,3-dione
Openeye Name:2-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)isoindoline-1,3-dione
CAS Name:2-[2-(phenacylthio)-1,3-benzothiazol-6-yl]isoindole-1,3-dione
IUPAC Name:2-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)isoindole-1,3-dione
Traditional Name:2-[2-(phenacylthio)-1,3-benzothiazol-6-yl]isoindoline-1,3-quinone
Formula: C23H14N2O3S2
MolecularWeight: 430.49886
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O


Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O


InChI

InChI=1S/C23H14N2O3S2/c26-19(14-6-2-1-3-7-14)13-29-23-24-18-11-10-15(12-20(18)30-23)25-21(27)16-8-4-5-9-17(16)22(25)28/h1-12H,13H2


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