N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-8-carboxamide

Systemtic Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-8-carboxamide Openeye Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-8-carboxamide CAS Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-8-quinolinecarboxamide IUPAC Name: N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]quinoline-8-carboxamide Traditional Name: N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]quinoline-8-carboxamide Formula: C20H17N5O MolecularWeight: 343.38188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4)N=CC=C2

InChI

InChI=1S/C20H17N5O/c26-20(18-5-1-3-17-4-2-10-22-19(17)18)23-11-15-6-8-16(9-7-15)12-25-14-21-13-24-25/h1-10,13-14H,11-12H2,(H,23,26)