4-butyl-N-[4-[5-(2-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide

Systemtic Name: 4-butyl-N-[4-[5-(2-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide Openeye Name: 4-butyl-N-[4-[3-isopropoxy-5-(o-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide CAS Name: 4-butyl-N-[4-[5-(2-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide IUPAC Name: 4-butyl-N-[4-[5-(2-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide Traditional Name: 4-butyl-N-[4-[3-isopropoxy-5-(o-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide Formula: C29H32N4O2 MolecularWeight: 468.58998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OC(C)C)C4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OC(C)C)C4=CC=CC=C4C

InChI

InChI=1S/C29H32N4O2/c1-5-6-10-22-12-14-23(15-13-22)28(34)30-24-16-18-25(19-17-24)33-27(26-11-8-7-9-21(26)4)31-29(32-33)35-20(2)3/h7-9,11-20H,5-6,10H2,1-4H3,(H,30,34)