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

Systemtic Name: 4-butoxy-N-[4-[5-(2-methylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]phenyl]benzamide Openeye Name: 4-butoxy-N-[4-[3-isobutoxy-5-(o-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide CAS Name: 4-butoxy-N-[4-[5-(2-methylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-[5-(2-methylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]phenyl]benzamide Traditional Name: 4-butoxy-N-[4-[3-isobutoxy-5-(o-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide Formula: C30H34N4O3 MolecularWeight: 498.61596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OCC(C)C)C4=CC=CC=C4C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C(=NC(=N3)OCC(C)C)C4=CC=CC=C4C

InChI

InChI=1S/C30H34N4O3/c1-5-6-19-36-26-17-11-23(12-18-26)29(35)31-24-13-15-25(16-14-24)34-28(27-10-8-7-9-22(27)4)32-30(33-34)37-20-21(2)3/h7-18,21H,5-6,19-20H2,1-4H3,(H,31,35)