BV9

?

Summary

Name:4-[5-(1-methylpyrazol-4-yl)pyridin-3-yl]benzamide
Formula:C16 H14 N4 O
Formal charge:0
Molecular weight:278.309 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-[5-(1-methylpyrazol-4-yl)pyridin-3-yl]benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C16H14N4O/c1-20-10-15(9-19-20)14-6-13(7-18-8-14)11-2-4-12(5-3-11)16(17)21/h2-10H,1H3,(H2,17,21)
InChIKeyInChI1.03MUFGPGISRVJPDN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cn1cc(cn1)c2cncc(c2)c3ccc(cc3)C(N)=O
SMILESCACTVS3.385Cn1cc(cn1)c2cncc(c2)c3ccc(cc3)C(N)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6Cn1cc(cn1)c2cc(cnc2)c3ccc(cc3)C(=O)N
SMILESOpenEye OEToolkits2.0.6Cn1cc(cn1)c2cc(cnc2)c3ccc(cc3)C(=O)N