N-[[5-(2-methyl-1,2,4-triazol-3-yl)-1-benzofuran-7-yl]methyl]-1-phenyl-piperidin-3-amine

Systemtic Name: N-[[5-(2-methyl-1,2,4-triazol-3-yl)-1-benzofuran-7-yl]methyl]-1-phenyl-piperidin-3-amine Openeye Name: N-[[5-(2-methyl-1,2,4-triazol-3-yl)benzofuran-7-yl]methyl]-1-phenyl-piperidin-3-amine CAS Name: N-[[5-(2-methyl-1,2,4-triazol-3-yl)-7-benzofuranyl]methyl]-1-phenyl-3-piperidinamine IUPAC Name: N-[[5-(2-methyl-1,2,4-triazol-3-yl)-1-benzofuran-7-yl]methyl]-1-phenylpiperidin-3-amine Traditional Name: [5-(2-methyl-1,2,4-triazol-3-yl)benzofuran-7-yl]methyl-(1-phenyl-3-piperidyl)amine Formula: C23H25N5O MolecularWeight: 387.4775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)C2=CC(=C3C(=C2)C=CO3)CNC4CCCN(C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=NC=N1)C2=CC(=C3C(=C2)C=CO3)CNC4CCCN(C4)C5=CC=CC=C5

InChI

InChI=1S/C23H25N5O/c1-27-23(25-16-26-27)18-12-17-9-11-29-22(17)19(13-18)14-24-20-6-5-10-28(15-20)21-7-3-2-4-8-21/h2-4,7-9,11-13,16,20,24H,5-6,10,14-15H2,1H3