V8O

5-(5-methyl-6-quinolin-5-yl-pyridin-3-yl)thiophene-2-sulfonamide

Created:2023-02-27
Last modified:  2023-12-13

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Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count44
Aromatic Bond Count22
2D diagram of V8O

Chemical Component Summary

Name5-(5-methyl-6-quinolin-5-yl-pyridin-3-yl)thiophene-2-sulfonamide
Systematic Name (OpenEye OEToolkits)5-(5-methyl-6-quinolin-5-yl-pyridin-3-yl)thiophene-2-sulfonamide
FormulaC19 H15 N3 O2 S2
Molecular Weight381.471
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385Cc1cc(cnc1c2cccc3ncccc23)c4sc(cc4)[S](N)(=O)=O
SMILESOpenEye OEToolkits2.0.7Cc1cc(cnc1c2cccc3c2cccn3)c4ccc(s4)S(=O)(=O)N
Canonical SMILESCACTVS3.385 Cc1cc(cnc1c2cccc3ncccc23)c4sc(cc4)[S](N)(=O)=O
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1cc(cnc1c2cccc3c2cccn3)c4ccc(s4)S(=O)(=O)N
InChIInChI1.06 InChI=1S/C19H15N3O2S2/c1-12-10-13(17-7-8-18(25-17)26(20,23)24)11-22-19(12)15-4-2-6-16-14(15)5-3-9-21-16/h2-11H,1H3,(H2,20,23,24)
InChIKeyInChI1.06 FBQWYQWUVBYRAC-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 169452176