Chemical Component Summary

NameN-[4-cyano-3-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-(2-oxo-3,4-dihydroquinolin-1(2H)-yl)acetamide
IdentifiersN-[4-cyano-3-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-(2-oxidanylidene-3,4-dihydroquinolin-1-yl)ethanamide
FormulaC18 H14 N6 O2 S
Molecular Weight378.408
TypeNON-POLYMER
Isomeric SMILESc1ccc2c(c1)CCC(=O)N2CC(=O)Nc3c(c(cs3)C#N)c4[nH]ncn4
InChIInChI=1S/C18H14N6O2S/c19-7-12-9-27-18(16(12)17-20-10-21-23-17)22-14(25)8-24-13-4-2-1-3-11(13)5-6-15(24)26/h1-4,9-10H,5-6,8H2,(H,22,25)(H,20,21,23)
InChIKeyWNRCGOJLZOLSJN-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count44
Aromatic Bond Count17

Related Resource References

Resource NameReference
Pharos CHEMBL1682015
PubChem 46869880
ChEMBL CHEMBL1682015