N-[4-[3-methoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-4-pentyl-benzamide

Systemtic Name: N-[4-[3-methoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-4-pentyl-benzamide Openeye Name: N-[4-[3-methoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]-4-pentyl-benzamide CAS Name: N-[4-[3-methoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-4-pentylbenzamide IUPAC Name: N-[4-[3-methoxy-5-(4-methylphenyl)-1,2,4-triazol-1-yl]phenyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[4-[3-methoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide Formula: C28H30N4O2 MolecularWeight: 454.5634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OC)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OC)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H30N4O2/c1-4-5-6-7-21-10-14-23(15-11-21)27(33)29-24-16-18-25(19-17-24)32-26(30-28(31-32)34-3)22-12-8-20(2)9-13-22/h8-19H,4-7H2,1-3H3,(H,29,33)