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2,3-dimethoxy-6-(2-pyridin-2-ylethynyl)thioxanthen-9-one

2,3-dimethoxy-6-(2-pyridin-2-ylethynyl)thioxanthen-9-one

Systemtic Name:2,3-dimethoxy-6-(2-pyridin-2-ylethynyl)thioxanthen-9-one
Openeye Name:2,3-dimethoxy-6-[2-(2-pyridyl)ethynyl]thioxanthen-9-one
CAS Name:2,3-dimethoxy-6-[2-(2-pyridinyl)ethynyl]-9-thioxanthenone
IUPAC Name:2,3-dimethoxy-6-(2-pyridin-2-ylethynyl)thioxanthen-9-one
Traditional Name:2,3-dimethoxy-6-[2-(2-pyridyl)ethynyl]thioxanthen-9-one
Formula: C22H15NO3S
MolecularWeight: 373.4244
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C3=C(S2)C=C(C=C3)C#CC4=CC=CC=N4)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C3=C(S2)C=C(C=C3)C#CC4=CC=CC=N4)OC


InChI

InChI=1S/C22H15NO3S/c1-25-18-12-17-21(13-19(18)26-2)27-20-11-14(7-9-16(20)22(17)24)6-8-15-5-3-4-10-23-15/h3-5,7,9-13H,1-2H3


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