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

Systemtic Name: 4-bromanyl-N-[4-[5-(4-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide Openeye Name: 4-bromo-N-[4-[3-isopropoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide CAS Name: 4-bromo-N-[4-[5-(4-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide IUPAC Name: 4-bromo-N-[4-[5-(4-methylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]phenyl]benzamide Traditional Name: 4-bromo-N-[4-[3-isopropoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]phenyl]benzamide Formula: C25H23BrN4O2 MolecularWeight: 491.37972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Br)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Br)OC(C)C

InChI

InChI=1S/C25H23BrN4O2/c1-16(2)32-25-28-23(18-6-4-17(3)5-7-18)30(29-25)22-14-12-21(13-15-22)27-24(31)19-8-10-20(26)11-9-19/h4-16H,1-3H3,(H,27,31)