1-[5-(furan-2-ylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[5-(furan-2-ylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[5-(2-furylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[5-(2-furanylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[5-(furan-2-ylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[5-(2-furfurylamino)-3-phenyl-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Formula: C22H20N4O2 MolecularWeight: 372.4198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CO4

InChI

InChI=1S/C22H20N4O2/c27-20(14-13-17-8-3-1-4-9-17)26-22(23-16-19-12-7-15-28-19)24-21(25-26)18-10-5-2-6-11-18/h1-12,15H,13-14,16H2,(H,23,24,25)